Benzenoids
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(4S)-(-)-4-Isopropyl-5,5-diphenyl-2-oxazolidinone 98.0+%, TCI America™
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CAS: 184346-45-0 Molecular Formula: C18H19NO2 Molecular Weight (g/mol): 281.355 MDL Number: MFCD03093556 InChI Key: PHTOJBANGYSTOH-INIZCTEOSA-N PubChem CID: 9838646 IUPAC Name: (4S)-5,5-diphenyl-4-propan-2-yl-1,3-oxazolidin-2-one SMILES: CC(C)C1C(OC(=O)N1)(C2=CC=CC=C2)C3=CC=CC=C3
| PubChem CID | 9838646 |
|---|---|
| CAS | 184346-45-0 |
| Molecular Weight (g/mol) | 281.355 |
| MDL Number | MFCD03093556 |
| SMILES | CC(C)C1C(OC(=O)N1)(C2=CC=CC=C2)C3=CC=CC=C3 |
| IUPAC Name | (4S)-5,5-diphenyl-4-propan-2-yl-1,3-oxazolidin-2-one |
| InChI Key | PHTOJBANGYSTOH-INIZCTEOSA-N |
| Molecular Formula | C18H19NO2 |
4-Phenylbutylamine 98.0+%, TCI America™
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CAS: 13214-66-9 Molecular Formula: C10H15N Molecular Weight (g/mol): 149.237 MDL Number: MFCD00008231 InChI Key: AGNFWIZBEATIAK-UHFFFAOYSA-N Synonym: 1-Amino-4-phenylbutane PubChem CID: 83242 IUPAC Name: 4-phenylbutan-1-amine SMILES: C1=CC=C(C=C1)CCCCN
| PubChem CID | 83242 |
|---|---|
| CAS | 13214-66-9 |
| Molecular Weight (g/mol) | 149.237 |
| MDL Number | MFCD00008231 |
| SMILES | C1=CC=C(C=C1)CCCCN |
| Synonym | 1-Amino-4-phenylbutane |
| IUPAC Name | 4-phenylbutan-1-amine |
| InChI Key | AGNFWIZBEATIAK-UHFFFAOYSA-N |
| Molecular Formula | C10H15N |
Methyl 4-Acetamido-2-methoxybenzoate 98.0+%, TCI America™
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CAS: 4093-29-2 Molecular Formula: C11H13NO4 Molecular Weight (g/mol): 223.23 MDL Number: MFCD00065258 InChI Key: OERVVBDWGVOBIS-UHFFFAOYSA-N Synonym: 4-Acetamido-2-methoxybenzoic Acid Methyl Ester, Methyl 4-Acetamido-o-anisate, 4-Acetamido-o-anisic Acid Methyl Ester PubChem CID: 77720 IUPAC Name: methyl 4-acetamido-2-methoxybenzoate SMILES: COC(=O)C1=CC=C(NC(C)=O)C=C1OC
| PubChem CID | 77720 |
|---|---|
| CAS | 4093-29-2 |
| Molecular Weight (g/mol) | 223.23 |
| MDL Number | MFCD00065258 |
| SMILES | COC(=O)C1=CC=C(NC(C)=O)C=C1OC |
| Synonym | 4-Acetamido-2-methoxybenzoic Acid Methyl Ester, Methyl 4-Acetamido-o-anisate, 4-Acetamido-o-anisic Acid Methyl Ester |
| IUPAC Name | methyl 4-acetamido-2-methoxybenzoate |
| InChI Key | OERVVBDWGVOBIS-UHFFFAOYSA-N |
| Molecular Formula | C11H13NO4 |
4-Amino-3-fluorobenzoic Acid 98.0+%, TCI America™
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CAS: 455-87-8 Molecular Formula: C7H6FNO2 Molecular Weight (g/mol): 155.128 MDL Number: MFCD01660374 InChI Key: JSKXHTHMCCDEGD-UHFFFAOYSA-N Synonym: 3-fluoro-4-aminobenzoic acid,benzoic acid, 4-amino-3-fluoro,4-amino-3-fluorobenzenecarboxylic acid,4-amino-3-fluoro-benzoic acid,4-amino-3-fluorobenzoicacid,pubchem3524,wln: zr bf dvq,acmc-209k3i,3-14-00-01153 beilstein handbook reference,buttpark 44\09-60 PubChem CID: 9971 IUPAC Name: 4-amino-3-fluorobenzoic acid SMILES: C1=CC(=C(C=C1C(=O)O)F)N
| PubChem CID | 9971 |
|---|---|
| CAS | 455-87-8 |
| Molecular Weight (g/mol) | 155.128 |
| MDL Number | MFCD01660374 |
| SMILES | C1=CC(=C(C=C1C(=O)O)F)N |
| Synonym | 3-fluoro-4-aminobenzoic acid,benzoic acid, 4-amino-3-fluoro,4-amino-3-fluorobenzenecarboxylic acid,4-amino-3-fluoro-benzoic acid,4-amino-3-fluorobenzoicacid,pubchem3524,wln: zr bf dvq,acmc-209k3i,3-14-00-01153 beilstein handbook reference,buttpark 44\09-60 |
| IUPAC Name | 4-amino-3-fluorobenzoic acid |
| InChI Key | JSKXHTHMCCDEGD-UHFFFAOYSA-N |
| Molecular Formula | C7H6FNO2 |
4-Mercaptobenzoic Acid 95.0+%, TCI America™
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CAS: 1074-36-8 Molecular Formula: C7H6O2S Molecular Weight (g/mol): 154.18 MDL Number: MFCD00016617 InChI Key: LMJXSOYPAOSIPZ-UHFFFAOYSA-N Synonym: 4-mercaptobenzoic acid,4-mercaptobenzoate,benzoic acid, 4-mercapto,4-mercapto-benzoic acid,4-mercapto benzoic acid,4-thiobenzoic acid,p-mercaptobenzoic acid,benzoic acid, p-mercapto,para-mercaptobenzoate,paracarboxythiophenol PubChem CID: 95738 IUPAC Name: 4-sulfanylbenzoic acid SMILES: OC(=O)C1=CC=C(S)C=C1
| PubChem CID | 95738 |
|---|---|
| CAS | 1074-36-8 |
| Molecular Weight (g/mol) | 154.18 |
| MDL Number | MFCD00016617 |
| SMILES | OC(=O)C1=CC=C(S)C=C1 |
| Synonym | 4-mercaptobenzoic acid,4-mercaptobenzoate,benzoic acid, 4-mercapto,4-mercapto-benzoic acid,4-mercapto benzoic acid,4-thiobenzoic acid,p-mercaptobenzoic acid,benzoic acid, p-mercapto,para-mercaptobenzoate,paracarboxythiophenol |
| IUPAC Name | 4-sulfanylbenzoic acid |
| InChI Key | LMJXSOYPAOSIPZ-UHFFFAOYSA-N |
| Molecular Formula | C7H6O2S |
Rafoxanide 98.0+%, TCI America™
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CAS: 22662-39-1 Molecular Formula: C19H11Cl2I2NO3 Molecular Weight (g/mol): 626.01 MDL Number: MFCD00682899 InChI Key: NEMNPWINWMHUMR-UHFFFAOYSA-N Synonym: 3′C-Chloro-4′C-(4-chlorophenoxy)-3,5-diiodosalicylanilide PubChem CID: 31475 IUPAC Name: N-[3-chloro-4-(4-chlorophenoxy)phenyl]-2-hydroxy-3,5-diiodobenzamide SMILES: OC1=C(I)C=C(I)C=C1C(=O)NC1=CC=C(OC2=CC=C(Cl)C=C2)C(Cl)=C1
| PubChem CID | 31475 |
|---|---|
| CAS | 22662-39-1 |
| Molecular Weight (g/mol) | 626.01 |
| MDL Number | MFCD00682899 |
| SMILES | OC1=C(I)C=C(I)C=C1C(=O)NC1=CC=C(OC2=CC=C(Cl)C=C2)C(Cl)=C1 |
| Synonym | 3′C-Chloro-4′C-(4-chlorophenoxy)-3,5-diiodosalicylanilide |
| IUPAC Name | N-[3-chloro-4-(4-chlorophenoxy)phenyl]-2-hydroxy-3,5-diiodobenzamide |
| InChI Key | NEMNPWINWMHUMR-UHFFFAOYSA-N |
| Molecular Formula | C19H11Cl2I2NO3 |
2-Bromo-4-fluorobenzyl Alcohol 98.0+%, TCI America™
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CAS: 229027-89-8 Molecular Formula: C7H6BrFO Molecular Weight (g/mol): 205.03 MDL Number: MFCD00672925 InChI Key: XGAMLBPEVCLQEJ-UHFFFAOYSA-N Synonym: 2-bromo-4-fluorophenyl methanol,2-bromo-4-fluorobenzyl alcohol,benzenemethanol, 2-bromo-4-fluoro,2-bromo-4-fluorophenyl methan-1-ol,2-bromo-4-fluorobenzenemethanol,benzenemethanol,2-bromo-4-fluoro,pubchem3222,acmc-1cqar,ksc550i1h,rarechem al bd 1088 PubChem CID: 2773347 IUPAC Name: (2-bromo-4-fluorophenyl)methanol SMILES: OCC1=C(Br)C=C(F)C=C1
| PubChem CID | 2773347 |
|---|---|
| CAS | 229027-89-8 |
| Molecular Weight (g/mol) | 205.03 |
| MDL Number | MFCD00672925 |
| SMILES | OCC1=C(Br)C=C(F)C=C1 |
| Synonym | 2-bromo-4-fluorophenyl methanol,2-bromo-4-fluorobenzyl alcohol,benzenemethanol, 2-bromo-4-fluoro,2-bromo-4-fluorophenyl methan-1-ol,2-bromo-4-fluorobenzenemethanol,benzenemethanol,2-bromo-4-fluoro,pubchem3222,acmc-1cqar,ksc550i1h,rarechem al bd 1088 |
| IUPAC Name | (2-bromo-4-fluorophenyl)methanol |
| InChI Key | XGAMLBPEVCLQEJ-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrFO |
2-Hydroxy-5-nitro-m-anisaldehyde 99.0+%, TCI America™
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CAS: 17028-61-4 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.15 MDL Number: MFCD00017033 InChI Key: HGKHVFKBOHFYSS-UHFFFAOYSA-N Synonym: 3-methoxy-5-nitrosalicylaldehyde,2-hydroxy-5-nitro-m-anisaldehyde,benzaldehyde, 2-hydroxy-3-methoxy-5-nitro,5-nitro-o-vanillin,acmc-1bt2m,3-methoxy-5-nitrosalicyladehyde,2-hydroxy-5-nitro-3-methoxybenzaldehyde,benzaldehyde,2-hydroxy-3-methoxy-5-nitro PubChem CID: 307886 IUPAC Name: 2-hydroxy-3-methoxy-5-nitrobenzaldehyde SMILES: COC1=CC(=CC(C=O)=C1O)[N+]([O-])=O
| PubChem CID | 307886 |
|---|---|
| CAS | 17028-61-4 |
| Molecular Weight (g/mol) | 197.15 |
| MDL Number | MFCD00017033 |
| SMILES | COC1=CC(=CC(C=O)=C1O)[N+]([O-])=O |
| Synonym | 3-methoxy-5-nitrosalicylaldehyde,2-hydroxy-5-nitro-m-anisaldehyde,benzaldehyde, 2-hydroxy-3-methoxy-5-nitro,5-nitro-o-vanillin,acmc-1bt2m,3-methoxy-5-nitrosalicyladehyde,2-hydroxy-5-nitro-3-methoxybenzaldehyde,benzaldehyde,2-hydroxy-3-methoxy-5-nitro |
| IUPAC Name | 2-hydroxy-3-methoxy-5-nitrobenzaldehyde |
| InChI Key | HGKHVFKBOHFYSS-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO5 |
4-(tert-Butoxycarbonylamino)benzoic Acid 98.0+%, TCI America™
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CAS: 66493-39-8 Molecular Formula: C12H15NO4 Molecular Weight (g/mol): 237.255 MDL Number: MFCD00037428 InChI Key: ZJDBQMWMDZEONW-UHFFFAOYSA-N Synonym: boc-4-abz-oh,4-boc-amino benzoic acid,4-tert-butoxycarbonyl amino benzoic acid,4-tert-butoxycarbonylamino-benzoic acid,n-boc-4-aminobenzoic acid,4-tert-butoxycarbonylaminobenzoic acid,4-tert-butoxycarbonylamino benzoic acid,boc-p-aminobenzoic acid,4-boc-amino-benzoic acid PubChem CID: 2755931 IUPAC Name: 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid SMILES: CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)O
| PubChem CID | 2755931 |
|---|---|
| CAS | 66493-39-8 |
| Molecular Weight (g/mol) | 237.255 |
| MDL Number | MFCD00037428 |
| SMILES | CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)O |
| Synonym | boc-4-abz-oh,4-boc-amino benzoic acid,4-tert-butoxycarbonyl amino benzoic acid,4-tert-butoxycarbonylamino-benzoic acid,n-boc-4-aminobenzoic acid,4-tert-butoxycarbonylaminobenzoic acid,4-tert-butoxycarbonylamino benzoic acid,boc-p-aminobenzoic acid,4-boc-amino-benzoic acid |
| IUPAC Name | 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid |
| InChI Key | ZJDBQMWMDZEONW-UHFFFAOYSA-N |
| Molecular Formula | C12H15NO4 |
Benzyl 6-Bromohexyl Ether 97.0+%, TCI America™
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CAS: 54247-27-7 Molecular Formula: C13H19BrO Molecular Weight (g/mol): 271.20 MDL Number: MFCD02258455 InChI Key: UHDZRWPKYMHVNV-UHFFFAOYSA-N Synonym: Benzyloxyhexyl Bromide, (6-Bromohexyloxymethyl)benzene PubChem CID: 2784764 IUPAC Name: {[(6-bromohexyl)oxy]methyl}benzene SMILES: BrCCCCCCOCC1=CC=CC=C1
| PubChem CID | 2784764 |
|---|---|
| CAS | 54247-27-7 |
| Molecular Weight (g/mol) | 271.20 |
| MDL Number | MFCD02258455 |
| SMILES | BrCCCCCCOCC1=CC=CC=C1 |
| Synonym | Benzyloxyhexyl Bromide, (6-Bromohexyloxymethyl)benzene |
| IUPAC Name | {[(6-bromohexyl)oxy]methyl}benzene |
| InChI Key | UHDZRWPKYMHVNV-UHFFFAOYSA-N |
| Molecular Formula | C13H19BrO |
Sodium 3-(N-Ethyl-3-methoxyanilino)-2-hydroxy-1-propanesulfonate 98.0+%, TCI America™
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CAS: 82692-96-4 Molecular Formula: C12H22NNaO7S Molecular Weight (g/mol): 347.36 MDL Number: MFCD09261431 InChI Key: PNGLEYLFMHGIQO-UHFFFAOYNA-M Synonym: 3-(N-Ethyl-3-methoxyanilino)-2-hydroxy-1-propanesulfonic Acid Sodium Salt, N-Ethyl-N-(2-hydroxy-3-sulfopropyl)-3-methoxyaniline Sodium Salt, ADOS PubChem CID: 71307074 IUPAC Name: sodium 3-[ethyl(3-methoxyphenyl)amino]-2-hydroxypropane-1-sulfonate dihydrate SMILES: O.O.[Na+].CCN(CC(O)CS([O-])(=O)=O)C1=CC(OC)=CC=C1
| PubChem CID | 71307074 |
|---|---|
| CAS | 82692-96-4 |
| Molecular Weight (g/mol) | 347.36 |
| MDL Number | MFCD09261431 |
| SMILES | O.O.[Na+].CCN(CC(O)CS([O-])(=O)=O)C1=CC(OC)=CC=C1 |
| Synonym | 3-(N-Ethyl-3-methoxyanilino)-2-hydroxy-1-propanesulfonic Acid Sodium Salt, N-Ethyl-N-(2-hydroxy-3-sulfopropyl)-3-methoxyaniline Sodium Salt, ADOS |
| IUPAC Name | sodium 3-[ethyl(3-methoxyphenyl)amino]-2-hydroxypropane-1-sulfonate dihydrate |
| InChI Key | PNGLEYLFMHGIQO-UHFFFAOYNA-M |
| Molecular Formula | C12H22NNaO7S |
4-Aminostyrene 95.0+%, TCI America™
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CAS: 1520-21-4 Molecular Formula: C8H9N Molecular Weight (g/mol): 119.167 MDL Number: MFCD00015329 InChI Key: LBSXSAXOLABXMF-UHFFFAOYSA-N PubChem CID: 73700 IUPAC Name: 4-ethenylaniline SMILES: C=CC1=CC=C(C=C1)N
| PubChem CID | 73700 |
|---|---|
| CAS | 1520-21-4 |
| Molecular Weight (g/mol) | 119.167 |
| MDL Number | MFCD00015329 |
| SMILES | C=CC1=CC=C(C=C1)N |
| IUPAC Name | 4-ethenylaniline |
| InChI Key | LBSXSAXOLABXMF-UHFFFAOYSA-N |
| Molecular Formula | C8H9N |
2,4,6-Tris(4-fluorophenyl)boroxin 98.0+%, TCI America™
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CAS: 448-59-9 Molecular Formula: C18H12B3F3O3 Molecular Weight (g/mol): 365.716 MDL Number: MFCD02093496 InChI Key: AHYNJLHYJZXUSD-UHFFFAOYSA-N Synonym: 4-Fluorophenylboronic Anhydride, Tris(4-fluorophenyl)cyclotriboroxane PubChem CID: 2769359 IUPAC Name: 2,4,6-tris(4-fluorophenyl)-1,3,5,2,4,6-trioxatriborinane SMILES: B1(OB(OB(O1)C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C4=CC=C(C=C4)F
| PubChem CID | 2769359 |
|---|---|
| CAS | 448-59-9 |
| Molecular Weight (g/mol) | 365.716 |
| MDL Number | MFCD02093496 |
| SMILES | B1(OB(OB(O1)C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C4=CC=C(C=C4)F |
| Synonym | 4-Fluorophenylboronic Anhydride, Tris(4-fluorophenyl)cyclotriboroxane |
| IUPAC Name | 2,4,6-tris(4-fluorophenyl)-1,3,5,2,4,6-trioxatriborinane |
| InChI Key | AHYNJLHYJZXUSD-UHFFFAOYSA-N |
| Molecular Formula | C18H12B3F3O3 |
4-Amino-3,5-dichlorobenzotrifluoride 98.0+%, TCI America™
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CAS: 24279-39-8 Molecular Formula: C7H4Cl2F3N Molecular Weight (g/mol): 230.01 MDL Number: MFCD00052918 InChI Key: ITNMAZSPBLRJLU-UHFFFAOYSA-N Synonym: 2,6-dichloro-4-trifluoromethyl aniline,4-amino-3,5-dichlorobenzotrifluoride,3,5-dichloro-4-amino benzotrifluoride,3,5-dichloro-4-aminobenzotrifluoride,2,6-dichloro-4-trifluoromethyl benzenamine,benzenamine, 2,6-dichloro-4-trifluoromethyl,2,6-dichloro-4-trifluoromethyl phenylamine,2,6-dichloro-4-trifluoromethyl-benzenamine,pubchem2187 PubChem CID: 141094 IUPAC Name: 2,6-dichloro-4-(trifluoromethyl)aniline SMILES: NC1=C(Cl)C=C(C=C1Cl)C(F)(F)F
| PubChem CID | 141094 |
|---|---|
| CAS | 24279-39-8 |
| Molecular Weight (g/mol) | 230.01 |
| MDL Number | MFCD00052918 |
| SMILES | NC1=C(Cl)C=C(C=C1Cl)C(F)(F)F |
| Synonym | 2,6-dichloro-4-trifluoromethyl aniline,4-amino-3,5-dichlorobenzotrifluoride,3,5-dichloro-4-amino benzotrifluoride,3,5-dichloro-4-aminobenzotrifluoride,2,6-dichloro-4-trifluoromethyl benzenamine,benzenamine, 2,6-dichloro-4-trifluoromethyl,2,6-dichloro-4-trifluoromethyl phenylamine,2,6-dichloro-4-trifluoromethyl-benzenamine,pubchem2187 |
| IUPAC Name | 2,6-dichloro-4-(trifluoromethyl)aniline |
| InChI Key | ITNMAZSPBLRJLU-UHFFFAOYSA-N |
| Molecular Formula | C7H4Cl2F3N |
Nepsilon-(tert-Butoxycarbonyl)-Nalpha-[(9H-fluoren-9-ylmethoxy)carbonyl]-D-lysine 98.0+%, TCI America™
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CAS: 92122-45-7 Molecular Formula: C26H32N2O6 Molecular Weight (g/mol): 468.55 MDL Number: MFCD00065660 InChI Key: UMRUUWFGLGNQLI-ANBDAQEENA-N Synonym: fmoc-d-lys boc-oh,nepsilon-tert-butoxycarbonyl-nalpha-9h-fluoren-9-ylmethoxy carbonyl-d-lysine,r-6-tert-butoxycarbonyl amino-2-9h-fluoren-9-yl methoxy carbonyl amino hexanoic acid,nepsilon-boc-nalpha-fmoc-d-lysine,r-2-9h-fluoren-9-yl methoxy carbonyl amino-6-tert-butoxycarbonyl amino hexanoic acid,n epsilon-tert-butoxycarbonyl-n alpha-9-fluorenylmethoxycarbonyl-d-lysine,n-alpha-9-fluorenylmethyloxycarbonyl-n-epsilon-t-butyl-oxycarbonyl-d-lysine,fmocdlys boc oh,2r-6-tert-butoxycarbonyl amino-2-9h-fluoren-9-ylmethoxy carbonyl amino hexanoic acid,ambotzfaa1330 PubChem CID: 13585941 IUPAC Name: (2R)-6-{[(tert-butoxy)carbonyl]amino}-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)hexanoic acid SMILES: CC(C)(C)OC(=O)NCCCC[C@@H](NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12)C(O)=O
| PubChem CID | 13585941 |
|---|---|
| CAS | 92122-45-7 |
| Molecular Weight (g/mol) | 468.55 |
| MDL Number | MFCD00065660 |
| SMILES | CC(C)(C)OC(=O)NCCCC[C@@H](NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12)C(O)=O |
| Synonym | fmoc-d-lys boc-oh,nepsilon-tert-butoxycarbonyl-nalpha-9h-fluoren-9-ylmethoxy carbonyl-d-lysine,r-6-tert-butoxycarbonyl amino-2-9h-fluoren-9-yl methoxy carbonyl amino hexanoic acid,nepsilon-boc-nalpha-fmoc-d-lysine,r-2-9h-fluoren-9-yl methoxy carbonyl amino-6-tert-butoxycarbonyl amino hexanoic acid,n epsilon-tert-butoxycarbonyl-n alpha-9-fluorenylmethoxycarbonyl-d-lysine,n-alpha-9-fluorenylmethyloxycarbonyl-n-epsilon-t-butyl-oxycarbonyl-d-lysine,fmocdlys boc oh,2r-6-tert-butoxycarbonyl amino-2-9h-fluoren-9-ylmethoxy carbonyl amino hexanoic acid,ambotzfaa1330 |
| IUPAC Name | (2R)-6-{[(tert-butoxy)carbonyl]amino}-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)hexanoic acid |
| InChI Key | UMRUUWFGLGNQLI-ANBDAQEENA-N |
| Molecular Formula | C26H32N2O6 |