Benzenoids
Filtered Search Results
3,4-Dimethoxyphenol 97.0+%, TCI America™
CAS: 2033-89-8 Molecular Formula: C8H10O3 Molecular Weight (g/mol): 154.165 InChI Key: SMFFZOQLHYIRDA-UHFFFAOYSA-N Synonym: phenol, 3,4-dimethoxy,4-hydroxyveratrole,3,4-bis methyloxy phenol,unii-38b43wcu83,3,4-dimethoxy phenol,3,4-dimethoxyphel,3,4,dimethoxyphenol,phenol,4-dimethoxy,3,4-dimethoxy-pheno,pubchem4113 PubChem CID: 16251 IUPAC Name: 3,4-dimethoxyphenol SMILES: COC1=C(C=C(C=C1)O)OC
| PubChem CID | 16251 |
|---|---|
| CAS | 2033-89-8 |
| Molecular Weight (g/mol) | 154.165 |
| SMILES | COC1=C(C=C(C=C1)O)OC |
| Synonym | phenol, 3,4-dimethoxy,4-hydroxyveratrole,3,4-bis methyloxy phenol,unii-38b43wcu83,3,4-dimethoxy phenol,3,4-dimethoxyphel,3,4,dimethoxyphenol,phenol,4-dimethoxy,3,4-dimethoxy-pheno,pubchem4113 |
| IUPAC Name | 3,4-dimethoxyphenol |
| InChI Key | SMFFZOQLHYIRDA-UHFFFAOYSA-N |
| Molecular Formula | C8H10O3 |
Pararosaniline Hydrochloride 95.0+%, TCI America™
CAS: 569-61-9 Molecular Formula: C19H18ClN3 Molecular Weight (g/mol): 323.824 MDL Number: MFCD00001657 InChI Key: JUQPZRLQQYSMEQ-UHFFFAOYSA-N Synonym: basic red 9,pararosaniline hydrochloride,parafuchsin,pararosaniline chloride,parafuchsine,p-fuchsin,basic fuchsin,ci basic red 9,c.i. basic red 9,parafuksin PubChem CID: 11292 ChEBI: CHEBI:87663 IUPAC Name: 4-[(4-aminophenyl)-(4-iminocyclohexa-2,5-dien-1-ylidene)methyl]aniline;hydrochloride SMILES: C1=CC(=N)C=CC1=C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N.Cl
| PubChem CID | 11292 |
|---|---|
| CAS | 569-61-9 |
| Molecular Weight (g/mol) | 323.824 |
| ChEBI | CHEBI:87663 |
| MDL Number | MFCD00001657 |
| SMILES | C1=CC(=N)C=CC1=C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N.Cl |
| Synonym | basic red 9,pararosaniline hydrochloride,parafuchsin,pararosaniline chloride,parafuchsine,p-fuchsin,basic fuchsin,ci basic red 9,c.i. basic red 9,parafuksin |
| IUPAC Name | 4-[(4-aminophenyl)-(4-iminocyclohexa-2,5-dien-1-ylidene)methyl]aniline;hydrochloride |
| InChI Key | JUQPZRLQQYSMEQ-UHFFFAOYSA-N |
| Molecular Formula | C19H18ClN3 |
3-Chloro-4-fluorobenzyl Bromide 98.0+%, TCI America™
CAS: 192702-01-5 Molecular Formula: C7H5BrClF Molecular Weight (g/mol): 223.47 MDL Number: MFCD01631551 InChI Key: GGTQWWTYUKXFPP-UHFFFAOYSA-N Synonym: 3-chloro-4-fluorobenzyl bromide,4-bromomethyl-2-chloro-1-fluorobenzene,alpha-bromo-3-chloro-4-fluorotoluene,1-bromomethyl-3-chloro-4-fluorobenzene,3-chloro-4-fluorobenzylbromide,3-chloro-4-fluoro benzyl bromide,benzene, 4-bromomethyl-2-chloro-1-fluoro,pubchem2130,acmc-209ewf,4-bromomethyl-2-chloro-1-fluoro-benzene PubChem CID: 2757542 IUPAC Name: 4-(bromomethyl)-2-chloro-1-fluorobenzene SMILES: FC1=CC=C(CBr)C=C1Cl
| PubChem CID | 2757542 |
|---|---|
| CAS | 192702-01-5 |
| Molecular Weight (g/mol) | 223.47 |
| MDL Number | MFCD01631551 |
| SMILES | FC1=CC=C(CBr)C=C1Cl |
| Synonym | 3-chloro-4-fluorobenzyl bromide,4-bromomethyl-2-chloro-1-fluorobenzene,alpha-bromo-3-chloro-4-fluorotoluene,1-bromomethyl-3-chloro-4-fluorobenzene,3-chloro-4-fluorobenzylbromide,3-chloro-4-fluoro benzyl bromide,benzene, 4-bromomethyl-2-chloro-1-fluoro,pubchem2130,acmc-209ewf,4-bromomethyl-2-chloro-1-fluoro-benzene |
| IUPAC Name | 4-(bromomethyl)-2-chloro-1-fluorobenzene |
| InChI Key | GGTQWWTYUKXFPP-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrClF |
4-Methoxy-2-methylbenzoic Acid 98.0+%, TCI America™
CAS: 6245-57-4 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00020291 InChI Key: MSVRGYOYISBGTH-UHFFFAOYSA-N Synonym: 2-methyl-4-methoxybenzoic acid,4-methoxy-2-methyl-benzoic acid,2-methyl-p-anisic acid,benzoic acid, 4-methoxy-2-methyl,4-methoxy-o-toluic acid,acmc-209x9h,ksc495k2d,2-methyl-4-methoxybenzoicacid,2-methyl-4-methoxy-benzoic acid,4-methoxy-2-methyl benzoic acid PubChem CID: 597216 IUPAC Name: 4-methoxy-2-methylbenzoic acid SMILES: COC1=CC(C)=C(C=C1)C(O)=O
| PubChem CID | 597216 |
|---|---|
| CAS | 6245-57-4 |
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00020291 |
| SMILES | COC1=CC(C)=C(C=C1)C(O)=O |
| Synonym | 2-methyl-4-methoxybenzoic acid,4-methoxy-2-methyl-benzoic acid,2-methyl-p-anisic acid,benzoic acid, 4-methoxy-2-methyl,4-methoxy-o-toluic acid,acmc-209x9h,ksc495k2d,2-methyl-4-methoxybenzoicacid,2-methyl-4-methoxy-benzoic acid,4-methoxy-2-methyl benzoic acid |
| IUPAC Name | 4-methoxy-2-methylbenzoic acid |
| InChI Key | MSVRGYOYISBGTH-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
3-Fluoro-4-(trifluoromethyl)benzonitrile 99.0+%, TCI America™
CAS: 231953-38-1 Molecular Formula: C8H3F4N Molecular Weight (g/mol): 189.113 MDL Number: MFCD00236280 InChI Key: CFPNGJCBTZAVDN-UHFFFAOYSA-N Synonym: 3-fluoro-4-trifluoromethyl benzonitrile,4-cyano-2-fluorobenzotrifluoride,benzonitrile, 3-fluoro-4-trifluoromethyl,3-fluoro-4-trifluoromethyl benzenecarbonitrile,alpha,alpha,alpha,3-tetrafluoro-p-tolunitrile,pubchem4800,acmc-1cq1l,intermediates-zcf02625,ksc495o7j,3-fluoro-4-trifluoromethyl-benzonitrile PubChem CID: 2737550 IUPAC Name: 3-fluoro-4-(trifluoromethyl)benzonitrile SMILES: C1=CC(=C(C=C1C#N)F)C(F)(F)F
| PubChem CID | 2737550 |
|---|---|
| CAS | 231953-38-1 |
| Molecular Weight (g/mol) | 189.113 |
| MDL Number | MFCD00236280 |
| SMILES | C1=CC(=C(C=C1C#N)F)C(F)(F)F |
| Synonym | 3-fluoro-4-trifluoromethyl benzonitrile,4-cyano-2-fluorobenzotrifluoride,benzonitrile, 3-fluoro-4-trifluoromethyl,3-fluoro-4-trifluoromethyl benzenecarbonitrile,alpha,alpha,alpha,3-tetrafluoro-p-tolunitrile,pubchem4800,acmc-1cq1l,intermediates-zcf02625,ksc495o7j,3-fluoro-4-trifluoromethyl-benzonitrile |
| IUPAC Name | 3-fluoro-4-(trifluoromethyl)benzonitrile |
| InChI Key | CFPNGJCBTZAVDN-UHFFFAOYSA-N |
| Molecular Formula | C8H3F4N |
(1,3-Dioxolan-2-yl)methyltriphenylphosphonium Bromide 97.0+%, TCI America™
CAS: 52509-14-5 Molecular Formula: C22H22BrO2P Molecular Weight (g/mol): 429.29 MDL Number: MFCD00011966 InChI Key: FRHRVQQUICVJDG-UHFFFAOYSA-M Synonym: 1,3-dioxolan-2-ylmethyl triphenylphosphonium bromide,1,3-dioxolan-2-yl methyl triphenylphosphonium bromide,1,3-dioxolan-2-ylmethyl triphenylphosphanium bromide,phosphonium, 1,3-dioxolan-2-ylmethyl triphenyl-, bromide,1,3-dioxolan-2-yl methyltriphenylphosphonium bromide,1,3-dioxolan-2-ylmethyl triphenyl phosphanium bromide,1,3-dioxolan-2-ylmethyl triphenyl phosphonium bromide,1,3-dioxolan-2-ylmethyl triphenylphosphine, bromide,acmc-209kzy PubChem CID: 2724194 IUPAC Name: [(1,3-dioxolan-2-yl)methyl]triphenylphosphanium bromide SMILES: [Br-].C(C1OCCO1)[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 2724194 |
|---|---|
| CAS | 52509-14-5 |
| Molecular Weight (g/mol) | 429.29 |
| MDL Number | MFCD00011966 |
| SMILES | [Br-].C(C1OCCO1)[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | 1,3-dioxolan-2-ylmethyl triphenylphosphonium bromide,1,3-dioxolan-2-yl methyl triphenylphosphonium bromide,1,3-dioxolan-2-ylmethyl triphenylphosphanium bromide,phosphonium, 1,3-dioxolan-2-ylmethyl triphenyl-, bromide,1,3-dioxolan-2-yl methyltriphenylphosphonium bromide,1,3-dioxolan-2-ylmethyl triphenyl phosphanium bromide,1,3-dioxolan-2-ylmethyl triphenyl phosphonium bromide,1,3-dioxolan-2-ylmethyl triphenylphosphine, bromide,acmc-209kzy |
| IUPAC Name | [(1,3-dioxolan-2-yl)methyl]triphenylphosphanium bromide |
| InChI Key | FRHRVQQUICVJDG-UHFFFAOYSA-M |
| Molecular Formula | C22H22BrO2P |
3-Cyanobenzoic Acid 98.0+%, TCI America™
CAS: 1877-72-1 Molecular Formula: C8H5NO2 Molecular Weight (g/mol): 147.133 MDL Number: MFCD00002486 InChI Key: GYLKKXHEIIFTJH-UHFFFAOYSA-N Synonym: m-cyanobenzoic acid,benzoic acid, 3-cyano,3-carboxybenzonitrile,3-cyano-benzoic acid,3-cyanobenzoicacid,benzoic acid, m-cyano,unii-d2gc692d78,3-cyano-benzoicacid,m-carboxybenzonitrile,3-cyano benzoic acid PubChem CID: 15875 IUPAC Name: 3-cyanobenzoic acid SMILES: C1=CC(=CC(=C1)C(=O)O)C#N
| PubChem CID | 15875 |
|---|---|
| CAS | 1877-72-1 |
| Molecular Weight (g/mol) | 147.133 |
| MDL Number | MFCD00002486 |
| SMILES | C1=CC(=CC(=C1)C(=O)O)C#N |
| Synonym | m-cyanobenzoic acid,benzoic acid, 3-cyano,3-carboxybenzonitrile,3-cyano-benzoic acid,3-cyanobenzoicacid,benzoic acid, m-cyano,unii-d2gc692d78,3-cyano-benzoicacid,m-carboxybenzonitrile,3-cyano benzoic acid |
| IUPAC Name | 3-cyanobenzoic acid |
| InChI Key | GYLKKXHEIIFTJH-UHFFFAOYSA-N |
| Molecular Formula | C8H5NO2 |
Dipotassium (R)-1,1'-Binaphthyl-2,2'-disulfonate 98.0+%, TCI America™
CAS: 1092934-19-4 Molecular Formula: C20H12K2O6S2 Molecular Weight (g/mol): 490.627 InChI Key: ALWKFXOUXLSOSQ-UHFFFAOYSA-L Synonym: (R)-BINSA Dipotassium Salt, (R)-1,1′C-Binaphthyl-2,2′C-disulfonic Acid Dipotassium Salt PubChem CID: 87548207 IUPAC Name: dipotassium;1-(2-sulfonatonaphthalen-1-yl)naphthalene-2-sulfonate SMILES: C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)S(=O)(=O)[O-])S(=O)(=O)[O-].[K+].[K+]
| PubChem CID | 87548207 |
|---|---|
| CAS | 1092934-19-4 |
| Molecular Weight (g/mol) | 490.627 |
| SMILES | C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)S(=O)(=O)[O-])S(=O)(=O)[O-].[K+].[K+] |
| Synonym | (R)-BINSA Dipotassium Salt, (R)-1,1′C-Binaphthyl-2,2′C-disulfonic Acid Dipotassium Salt |
| IUPAC Name | dipotassium;1-(2-sulfonatonaphthalen-1-yl)naphthalene-2-sulfonate |
| InChI Key | ALWKFXOUXLSOSQ-UHFFFAOYSA-L |
| Molecular Formula | C20H12K2O6S2 |
2,4'-Dihydroxybenzophenone 98.0+%, TCI America™
CAS: 606-12-2 Molecular Formula: C13H10O3 Molecular Weight (g/mol): 214.22 MDL Number: MFCD02181674 InChI Key: HUYKZYIAFUBPAQ-UHFFFAOYSA-N PubChem CID: 220295 IUPAC Name: (2-hydroxyphenyl)-(4-hydroxyphenyl)methanone SMILES: C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)O)O
| PubChem CID | 220295 |
|---|---|
| CAS | 606-12-2 |
| Molecular Weight (g/mol) | 214.22 |
| MDL Number | MFCD02181674 |
| SMILES | C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)O)O |
| IUPAC Name | (2-hydroxyphenyl)-(4-hydroxyphenyl)methanone |
| InChI Key | HUYKZYIAFUBPAQ-UHFFFAOYSA-N |
| Molecular Formula | C13H10O3 |
Potassium 7-Hydroxy-1-naphthalenesulfonate (contains isomer) 90.0+%, TCI America™
CAS: 30252-40-5 Molecular Formula: C10H7KO4S Molecular Weight (g/mol): 262.32 MDL Number: MFCD00065327 InChI Key: UZBFJXMJCARTGH-UHFFFAOYSA-M PubChem CID: 23663680 IUPAC Name: potassium 7-hydroxynaphthalene-1-sulfonate SMILES: [K+].OC1=CC=C2C=CC=C(C2=C1)S([O-])(=O)=O
| PubChem CID | 23663680 |
|---|---|
| CAS | 30252-40-5 |
| Molecular Weight (g/mol) | 262.32 |
| MDL Number | MFCD00065327 |
| SMILES | [K+].OC1=CC=C2C=CC=C(C2=C1)S([O-])(=O)=O |
| IUPAC Name | potassium 7-hydroxynaphthalene-1-sulfonate |
| InChI Key | UZBFJXMJCARTGH-UHFFFAOYSA-M |
| Molecular Formula | C10H7KO4S |
1,2-Benzofluorene 95.0+%, TCI America™
CAS: 238-84-6 Molecular Formula: C17H12 Molecular Weight (g/mol): 216.283 MDL Number: MFCD00039578 InChI Key: HKMTVMBEALTRRR-UHFFFAOYSA-N Synonym: 1,2-benzofluorene,11h-benzo a fluorene,chrysofluorene,benzo a fluorene,alpha-naphthofluorene,benzo a fluorene van,unii-65ep6zt62k,2,3-benzopyrene PubChem CID: 9195 ChEBI: CHEBI:82402 IUPAC Name: 11H-benzo[a]fluorene SMILES: C1C2=CC=CC=C2C3=C1C4=CC=CC=C4C=C3
| PubChem CID | 9195 |
|---|---|
| CAS | 238-84-6 |
| Molecular Weight (g/mol) | 216.283 |
| ChEBI | CHEBI:82402 |
| MDL Number | MFCD00039578 |
| SMILES | C1C2=CC=CC=C2C3=C1C4=CC=CC=C4C=C3 |
| Synonym | 1,2-benzofluorene,11h-benzo a fluorene,chrysofluorene,benzo a fluorene,alpha-naphthofluorene,benzo a fluorene van,unii-65ep6zt62k,2,3-benzopyrene |
| IUPAC Name | 11H-benzo[a]fluorene |
| InChI Key | HKMTVMBEALTRRR-UHFFFAOYSA-N |
| Molecular Formula | C17H12 |
N-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanesulfonamide 98.0+%, TCI America™
CAS: 616880-14-9 Molecular Formula: C13H20BNO4S Molecular Weight (g/mol): 297.176 MDL Number: MFCD05663876 InChI Key: NPSPNWPZDXQYAC-UHFFFAOYSA-N Synonym: n-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methanesulfonamide,4-methanesulfonylamino phenylboronic acid pinacol ester,4-methanesulfonylaminophenylboronic acid, pinacol ester,4-methanesulfonylaminophenylboronic acid pinacol ester,n-4-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methanesulfonamide,amtb416,4-methanesulfonylamino phenyl boronic acid pinacol ester,4-methanesulfonamido phenylboronic acid pinacol ester PubChem CID: 16217653 IUPAC Name: N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanesulfonamide SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)NS(=O)(=O)C
| PubChem CID | 16217653 |
|---|---|
| CAS | 616880-14-9 |
| Molecular Weight (g/mol) | 297.176 |
| MDL Number | MFCD05663876 |
| SMILES | B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)NS(=O)(=O)C |
| Synonym | n-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methanesulfonamide,4-methanesulfonylamino phenylboronic acid pinacol ester,4-methanesulfonylaminophenylboronic acid, pinacol ester,4-methanesulfonylaminophenylboronic acid pinacol ester,n-4-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methanesulfonamide,amtb416,4-methanesulfonylamino phenyl boronic acid pinacol ester,4-methanesulfonamido phenylboronic acid pinacol ester |
| IUPAC Name | N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanesulfonamide |
| InChI Key | NPSPNWPZDXQYAC-UHFFFAOYSA-N |
| Molecular Formula | C13H20BNO4S |
Ambroxol Hydrochloride 98.0+%, TCI America™
CAS: 23828-92-4 Molecular Formula: C13H19Br2ClN2O Molecular Weight (g/mol): 414.57 MDL Number: MFCD00078932 InChI Key: QNVKOSLOVOTXKF-UHFFFAOYSA-N Synonym: ambroxol hydrochloride,ambroxol hcl,mucoangin,mucosolvan,ambroxolhydrochloride,unii-cc995zmv90,cis-4-2-amino-3,5-dibromobenzyl amino cyclohexanol hydrochloride,trans-4-2-amino-3,5-dibromobenzyl amino cyclohexanol hydrochloride,ambroxol hydrochloride jan,lasolvan PubChem CID: 108013 IUPAC Name: hydrogen 4-{[(2-amino-3,5-dibromophenyl)methyl]amino}cyclohexan-1-ol chloride SMILES: [H+].[Cl-].NC1=C(Br)C=C(Br)C=C1CNC1CCC(O)CC1
| PubChem CID | 108013 |
|---|---|
| CAS | 23828-92-4 |
| Molecular Weight (g/mol) | 414.57 |
| MDL Number | MFCD00078932 |
| SMILES | [H+].[Cl-].NC1=C(Br)C=C(Br)C=C1CNC1CCC(O)CC1 |
| Synonym | ambroxol hydrochloride,ambroxol hcl,mucoangin,mucosolvan,ambroxolhydrochloride,unii-cc995zmv90,cis-4-2-amino-3,5-dibromobenzyl amino cyclohexanol hydrochloride,trans-4-2-amino-3,5-dibromobenzyl amino cyclohexanol hydrochloride,ambroxol hydrochloride jan,lasolvan |
| IUPAC Name | hydrogen 4-{[(2-amino-3,5-dibromophenyl)methyl]amino}cyclohexan-1-ol chloride |
| InChI Key | QNVKOSLOVOTXKF-UHFFFAOYSA-N |
| Molecular Formula | C13H19Br2ClN2O |
2-Chlorobenzoic Acid 98.0+%, TCI America™
CAS: 118-91-2 Molecular Formula: C7H5ClO2 Molecular Weight (g/mol): 156.565 MDL Number: MFCD00002412 InChI Key: IKCLCGXPQILATA-UHFFFAOYSA-N Synonym: o-chlorobenzoic acid,benzoic acid, o-chloro,benzoic acid, 2-chloro,2-cba,kyselina o-chlorbenzoova,chlorobenzoic acid,ocba,benzoic acid, chloro,2-chloro-benzoic acid,chlorobenzoate PubChem CID: 8374 ChEBI: CHEBI:30793 IUPAC Name: 2-chlorobenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)Cl
| PubChem CID | 8374 |
|---|---|
| CAS | 118-91-2 |
| Molecular Weight (g/mol) | 156.565 |
| ChEBI | CHEBI:30793 |
| MDL Number | MFCD00002412 |
| SMILES | C1=CC=C(C(=C1)C(=O)O)Cl |
| Synonym | o-chlorobenzoic acid,benzoic acid, o-chloro,benzoic acid, 2-chloro,2-cba,kyselina o-chlorbenzoova,chlorobenzoic acid,ocba,benzoic acid, chloro,2-chloro-benzoic acid,chlorobenzoate |
| IUPAC Name | 2-chlorobenzoic acid |
| InChI Key | IKCLCGXPQILATA-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClO2 |
Cloquintocet-mexyl 98.0+%, TCI America™
CAS: 99607-70-2 Molecular Formula: C18H22ClNO3 Molecular Weight (g/mol): 335.83 MDL Number: MFCD01632329 InChI Key: COYBRKAVBMYYSF-UHFFFAOYNA-N Synonym: cloquintocet-mexyl,1-methylhexyl 5-chloroquinolin-8-yloxy acetate,cloquintocet-mexyl iso,cloquintocet mexyl,cloquintocet-1-methylhexyl ester,heptan-2-yl 2-5-chloroquinolin-8-yl oxyacetate,heptan-2-yl 2-5-chloroquinolin-8-yl oxy acetate,acetic acid, 5-chloro-8-quinolinyl oxy-, 1-methylhexyl ester,rs-1-methylhexyl 5-chloroquinolin-8-yloxy acetate PubChem CID: 93528 IUPAC Name: heptan-2-yl 2-[(5-chloroquinolin-8-yl)oxy]acetate SMILES: CCCCCC(C)OC(=O)COC1=C2N=CC=CC2=C(Cl)C=C1
| PubChem CID | 93528 |
|---|---|
| CAS | 99607-70-2 |
| Molecular Weight (g/mol) | 335.83 |
| MDL Number | MFCD01632329 |
| SMILES | CCCCCC(C)OC(=O)COC1=C2N=CC=CC2=C(Cl)C=C1 |
| Synonym | cloquintocet-mexyl,1-methylhexyl 5-chloroquinolin-8-yloxy acetate,cloquintocet-mexyl iso,cloquintocet mexyl,cloquintocet-1-methylhexyl ester,heptan-2-yl 2-5-chloroquinolin-8-yl oxyacetate,heptan-2-yl 2-5-chloroquinolin-8-yl oxy acetate,acetic acid, 5-chloro-8-quinolinyl oxy-, 1-methylhexyl ester,rs-1-methylhexyl 5-chloroquinolin-8-yloxy acetate |
| IUPAC Name | heptan-2-yl 2-[(5-chloroquinolin-8-yl)oxy]acetate |
| InChI Key | COYBRKAVBMYYSF-UHFFFAOYNA-N |
| Molecular Formula | C18H22ClNO3 |