Benzenoids
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3-Iodo-4-methylaniline 98.0+%, TCI America™
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CAS: 35944-64-0 Molecular Formula: C7H8IN Molecular Weight (g/mol): 233.05 MDL Number: MFCD00047843 InChI Key: RRUDMHNAMZFNEK-UHFFFAOYSA-N Synonym: 3-iodo-p-toluidine,benzenamine, 3-iodo-4-methyl,4-amino-2-iodotoluene,p-toluidine, 3-iodo,3-iodo-4-methyl-aniline,benzenamine, 3-iodo-4-methyl-9ci,3-iodo-4-methyl-phenylamine,pubchem3314,3-iodo-4-methyl aniline,acmc-209ik4 PubChem CID: 118889 IUPAC Name: 3-iodo-4-methylaniline SMILES: CC1=CC=C(N)C=C1I
| PubChem CID | 118889 |
|---|---|
| CAS | 35944-64-0 |
| Molecular Weight (g/mol) | 233.05 |
| MDL Number | MFCD00047843 |
| SMILES | CC1=CC=C(N)C=C1I |
| Synonym | 3-iodo-p-toluidine,benzenamine, 3-iodo-4-methyl,4-amino-2-iodotoluene,p-toluidine, 3-iodo,3-iodo-4-methyl-aniline,benzenamine, 3-iodo-4-methyl-9ci,3-iodo-4-methyl-phenylamine,pubchem3314,3-iodo-4-methyl aniline,acmc-209ik4 |
| IUPAC Name | 3-iodo-4-methylaniline |
| InChI Key | RRUDMHNAMZFNEK-UHFFFAOYSA-N |
| Molecular Formula | C7H8IN |
4-(4-Bromophenyl)butyric Acid 98.0+%, TCI America™
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CAS: 35656-89-4 Molecular Formula: C10H11BrO2 Molecular Weight (g/mol): 243.1 MDL Number: MFCD00463170 InChI Key: AGIIMNQWNPUJPT-UHFFFAOYSA-N PubChem CID: 252732 IUPAC Name: 4-(4-bromophenyl)butanoic acid SMILES: C1=CC(=CC=C1CCCC(=O)O)Br
| PubChem CID | 252732 |
|---|---|
| CAS | 35656-89-4 |
| Molecular Weight (g/mol) | 243.1 |
| MDL Number | MFCD00463170 |
| SMILES | C1=CC(=CC=C1CCCC(=O)O)Br |
| IUPAC Name | 4-(4-bromophenyl)butanoic acid |
| InChI Key | AGIIMNQWNPUJPT-UHFFFAOYSA-N |
| Molecular Formula | C10H11BrO2 |
9-[(9H-Fluoren-9-ylmethoxy)carbonylamino]-4,7-dioxanonanoic Acid 98.0+%, TCI America™
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CAS: 872679-70-4 Molecular Formula: C22H25NO6 Molecular Weight (g/mol): 399.443 MDL Number: MFCD08064306 InChI Key: QWHLFJJLRVOHTM-UHFFFAOYSA-N Synonym: 9-(Fmoc-amino)-4,7-dioxanonanoic Acid, 3-[2-[2-[(9H-Fluoren-9-ylmethoxy)carbonylamino]ethoxy]ethoxy]propionic Acid, 3-[2-[2-(Fmoc-amino)ethoxy]ethoxy]propionic Acid, Fmoc-NH-PEG2-CH2CH2COOH PubChem CID: 51340973 IUPAC Name: 3-[2-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethoxy]ethoxy]propanoic acid SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCCOCCOCCC(=O)O
| PubChem CID | 51340973 |
|---|---|
| CAS | 872679-70-4 |
| Molecular Weight (g/mol) | 399.443 |
| MDL Number | MFCD08064306 |
| SMILES | C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCCOCCOCCC(=O)O |
| Synonym | 9-(Fmoc-amino)-4,7-dioxanonanoic Acid, 3-[2-[2-[(9H-Fluoren-9-ylmethoxy)carbonylamino]ethoxy]ethoxy]propionic Acid, 3-[2-[2-(Fmoc-amino)ethoxy]ethoxy]propionic Acid, Fmoc-NH-PEG2-CH2CH2COOH |
| IUPAC Name | 3-[2-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethoxy]ethoxy]propanoic acid |
| InChI Key | QWHLFJJLRVOHTM-UHFFFAOYSA-N |
| Molecular Formula | C22H25NO6 |
3-Chloro-5-fluoroanisole 96.0+%, TCI America™
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CAS: 202925-08-4 Molecular Formula: C7H6ClFO Molecular Weight (g/mol): 160.57 MDL Number: MFCD00070770 InChI Key: XPZBNEWAZPZUHF-UHFFFAOYSA-N PubChem CID: 2779258 IUPAC Name: 1-chloro-3-fluoro-5-methoxybenzene SMILES: COC1=CC(F)=CC(Cl)=C1
| PubChem CID | 2779258 |
|---|---|
| CAS | 202925-08-4 |
| Molecular Weight (g/mol) | 160.57 |
| MDL Number | MFCD00070770 |
| SMILES | COC1=CC(F)=CC(Cl)=C1 |
| IUPAC Name | 1-chloro-3-fluoro-5-methoxybenzene |
| InChI Key | XPZBNEWAZPZUHF-UHFFFAOYSA-N |
| Molecular Formula | C7H6ClFO |
4-Methyl-3-nitrophenylboronic Acid (contains varying amounts of Anhydride), TCI America™
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| PubChem CID | 2773515 |
|---|---|
| CAS | 80500-27-2 |
| Molecular Weight (g/mol) | 180.954 |
| MDL Number | MFCD00191550 |
| Physical Form | Crystalline Powder |
| SMILES | B(C1=CC(=C(C=C1)C)[N+](=O)[O-])(O)O |
| TSCA | No |
| IUPAC Name | (4-methyl-3-nitrophenyl)boronic acid |
| InChI Key | OASVXBRTNVFKFS-UHFFFAOYSA-N |
| Molecular Formula | C7H8BNO4 |
| Formula Weight | 180.95 |
3-Bromo-5-chlorobenzonitrile 98.0+%, TCI America™
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CAS: 304854-55-5 Molecular Formula: C7H3BrClN Molecular Weight (g/mol): 216.462 MDL Number: MFCD06200840 InChI Key: DRKWKPSNVQVDKZ-UHFFFAOYSA-N PubChem CID: 15965893 IUPAC Name: 3-bromo-5-chlorobenzonitrile SMILES: C1=C(C=C(C=C1Cl)Br)C#N
| PubChem CID | 15965893 |
|---|---|
| CAS | 304854-55-5 |
| Molecular Weight (g/mol) | 216.462 |
| MDL Number | MFCD06200840 |
| SMILES | C1=C(C=C(C=C1Cl)Br)C#N |
| IUPAC Name | 3-bromo-5-chlorobenzonitrile |
| InChI Key | DRKWKPSNVQVDKZ-UHFFFAOYSA-N |
| Molecular Formula | C7H3BrClN |
2,6-Dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol 98.0+%, TCI America™
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CAS: 269410-25-5 Molecular Formula: C14H21BO3 Molecular Weight (g/mol): 248.13 MDL Number: MFCD02093724 InChI Key: TYCKOBOJYNRIBO-UHFFFAOYSA-N Synonym: 2,6-dimethyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenol,4-hydroxy-3,5-dimethylphenylboronic acid pinacol ester,3,5-dimethyl-4-hydroxyphenylboronic acid pinacol ester,3,5-dimethyl-4-hydroxybenzeneboronic acid, pinacol ester,4-hydroxy-3,5-dimethylphenylboronic acid, pinacol ester,2,6-dimethyl-4-tetramethyl-1,3,2-dioxaborolan-2-yl phenol,2,6-dimethyl-4-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-phenol,2,6-dimethyl-4-4,4-5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenol,2-4-hydroxy-3,5-dimethylphenyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,phenol, 2,6-dimethyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl PubChem CID: 2734649 IUPAC Name: 2,6-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol SMILES: CC1=CC(=CC(C)=C1O)B1OC(C)(C)C(C)(C)O1
| PubChem CID | 2734649 |
|---|---|
| CAS | 269410-25-5 |
| Molecular Weight (g/mol) | 248.13 |
| MDL Number | MFCD02093724 |
| SMILES | CC1=CC(=CC(C)=C1O)B1OC(C)(C)C(C)(C)O1 |
| Synonym | 2,6-dimethyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenol,4-hydroxy-3,5-dimethylphenylboronic acid pinacol ester,3,5-dimethyl-4-hydroxyphenylboronic acid pinacol ester,3,5-dimethyl-4-hydroxybenzeneboronic acid, pinacol ester,4-hydroxy-3,5-dimethylphenylboronic acid, pinacol ester,2,6-dimethyl-4-tetramethyl-1,3,2-dioxaborolan-2-yl phenol,2,6-dimethyl-4-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-phenol,2,6-dimethyl-4-4,4-5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenol,2-4-hydroxy-3,5-dimethylphenyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,phenol, 2,6-dimethyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl |
| IUPAC Name | 2,6-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol |
| InChI Key | TYCKOBOJYNRIBO-UHFFFAOYSA-N |
| Molecular Formula | C14H21BO3 |
2,2-Bis(4-aminophenyl)hexafluoropropane 98.0+%, TCI America™
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CAS: 1095-78-9 Molecular Formula: C15H12F6N2 Molecular Weight (g/mol): 334.265 MDL Number: MFCD00039146 InChI Key: BEKFRNOZJSYWKZ-UHFFFAOYSA-N Synonym: 2,2-bis 4-aminophenyl hexafluoropropane,4,4'-perfluoropropane-2,2-diyl dianiline,4,4'-hexafluoroisopropylidene dianiline,4-2-4-aminophenyl-1,1,1,3,3,3-hexafluoropropan-2-yl aniline,benzenamine, 4,4'-2,2,2-trifluoro-1-trifluoromethyl ethylidene bis,acmc-1bon7,bekfrnozjsywkz-uhfffaoysa,2,2-bis-4-aminophenyl hexafluoropropane,4,4'-1,1,1,3,3,3-hexafluoropropane-2,2-diyl dianiline PubChem CID: 622236 IUPAC Name: 4-[2-(4-aminophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]aniline SMILES: C1=CC(=CC=C1C(C2=CC=C(C=C2)N)(C(F)(F)F)C(F)(F)F)N
| PubChem CID | 622236 |
|---|---|
| CAS | 1095-78-9 |
| Molecular Weight (g/mol) | 334.265 |
| MDL Number | MFCD00039146 |
| SMILES | C1=CC(=CC=C1C(C2=CC=C(C=C2)N)(C(F)(F)F)C(F)(F)F)N |
| Synonym | 2,2-bis 4-aminophenyl hexafluoropropane,4,4'-perfluoropropane-2,2-diyl dianiline,4,4'-hexafluoroisopropylidene dianiline,4-2-4-aminophenyl-1,1,1,3,3,3-hexafluoropropan-2-yl aniline,benzenamine, 4,4'-2,2,2-trifluoro-1-trifluoromethyl ethylidene bis,acmc-1bon7,bekfrnozjsywkz-uhfffaoysa,2,2-bis-4-aminophenyl hexafluoropropane,4,4'-1,1,1,3,3,3-hexafluoropropane-2,2-diyl dianiline |
| IUPAC Name | 4-[2-(4-aminophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]aniline |
| InChI Key | BEKFRNOZJSYWKZ-UHFFFAOYSA-N |
| Molecular Formula | C15H12F6N2 |
3,3-Diphenylpropylamine 98.0+%, TCI America™
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CAS: 5586-73-2 Molecular Formula: C15H17N Molecular Weight (g/mol): 211.308 MDL Number: MFCD00008202 InChI Key: KISZTEOELCMZPY-UHFFFAOYSA-N Synonym: 3,3-diphenylpropylamine,benzenepropanamine, .gamma.-phenyl,3-3-diphenylpropylamine,3,3-diphenylpropan-1-amin,acmc-209lpx,3.3-diphenylpropylamine,3,3 diphenylpropylamine,3,3-diphenyl propylamine,3,3-diphenyl-propylamine,3,3-diphenylpropylamine e PubChem CID: 79698 IUPAC Name: 3,3-diphenylpropan-1-amine SMILES: C1=CC=C(C=C1)C(CCN)C2=CC=CC=C2
| PubChem CID | 79698 |
|---|---|
| CAS | 5586-73-2 |
| Molecular Weight (g/mol) | 211.308 |
| MDL Number | MFCD00008202 |
| SMILES | C1=CC=C(C=C1)C(CCN)C2=CC=CC=C2 |
| Synonym | 3,3-diphenylpropylamine,benzenepropanamine, .gamma.-phenyl,3-3-diphenylpropylamine,3,3-diphenylpropan-1-amin,acmc-209lpx,3.3-diphenylpropylamine,3,3 diphenylpropylamine,3,3-diphenyl propylamine,3,3-diphenyl-propylamine,3,3-diphenylpropylamine e |
| IUPAC Name | 3,3-diphenylpropan-1-amine |
| InChI Key | KISZTEOELCMZPY-UHFFFAOYSA-N |
| Molecular Formula | C15H17N |
4-(Trifluoromethyl)benzaldehyde 95.0+%, TCI America™
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CAS: 455-19-6 Molecular Formula: C8H5F3O Molecular Weight (g/mol): 174.122 MDL Number: MFCD00006952 InChI Key: BEOBZEOPTQQELP-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzaldehyde,benzaldehyde, 4-trifluoromethyl,p-trifluoromethylbenzaldehyde,p-trifluoromethyl benzaldehyde,alpha,alpha,alpha-trifluoro-p-tolualdehyde,4'-trifluoromethyl benzaldehyde,p-trifluoromethyl-benzaldhyde,4-trifluoromethyl-benzaldehyde PubChem CID: 67996 IUPAC Name: 4-(trifluoromethyl)benzaldehyde SMILES: C1=CC(=CC=C1C=O)C(F)(F)F
| PubChem CID | 67996 |
|---|---|
| CAS | 455-19-6 |
| Molecular Weight (g/mol) | 174.122 |
| MDL Number | MFCD00006952 |
| SMILES | C1=CC(=CC=C1C=O)C(F)(F)F |
| Synonym | 4-trifluoromethyl benzaldehyde,benzaldehyde, 4-trifluoromethyl,p-trifluoromethylbenzaldehyde,p-trifluoromethyl benzaldehyde,alpha,alpha,alpha-trifluoro-p-tolualdehyde,4'-trifluoromethyl benzaldehyde,p-trifluoromethyl-benzaldhyde,4-trifluoromethyl-benzaldehyde |
| IUPAC Name | 4-(trifluoromethyl)benzaldehyde |
| InChI Key | BEOBZEOPTQQELP-UHFFFAOYSA-N |
| Molecular Formula | C8H5F3O |
Ethyl 2-Chloro-6-fluorophenylacetate 98.0+%, TCI America™
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CAS: 214262-85-8 Molecular Formula: C10H10ClFO2 Molecular Weight (g/mol): 216.636 MDL Number: MFCD00800606 InChI Key: CEWCLHPMDWPDNQ-UHFFFAOYSA-N PubChem CID: 2733231 IUPAC Name: ethyl 2-(2-chloro-6-fluorophenyl)acetate SMILES: CCOC(=O)CC1=C(C=CC=C1Cl)F
| PubChem CID | 2733231 |
|---|---|
| CAS | 214262-85-8 |
| Molecular Weight (g/mol) | 216.636 |
| MDL Number | MFCD00800606 |
| SMILES | CCOC(=O)CC1=C(C=CC=C1Cl)F |
| IUPAC Name | ethyl 2-(2-chloro-6-fluorophenyl)acetate |
| InChI Key | CEWCLHPMDWPDNQ-UHFFFAOYSA-N |
| Molecular Formula | C10H10ClFO2 |
Ethyl 4-Bromo-3-methylbenzoate 98.0+%, TCI America™
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CAS: 160313-69-9 Molecular Formula: C10H11BrO2 Molecular Weight (g/mol): 243.10 MDL Number: MFCD00673007 InChI Key: GIGDAWLJINYIFV-UHFFFAOYSA-N Synonym: 4-Bromo-3-methylbenzoic Acid Ethyl Ester, Ethyl 4-Bromo-m-toluate, 4-Bromo-m-toluic Acid Ethyl Ester PubChem CID: 21729626 IUPAC Name: ethyl 4-bromo-3-methylbenzoate SMILES: CCOC(=O)C1=CC(C)=C(Br)C=C1
| PubChem CID | 21729626 |
|---|---|
| CAS | 160313-69-9 |
| Molecular Weight (g/mol) | 243.10 |
| MDL Number | MFCD00673007 |
| SMILES | CCOC(=O)C1=CC(C)=C(Br)C=C1 |
| Synonym | 4-Bromo-3-methylbenzoic Acid Ethyl Ester, Ethyl 4-Bromo-m-toluate, 4-Bromo-m-toluic Acid Ethyl Ester |
| IUPAC Name | ethyl 4-bromo-3-methylbenzoate |
| InChI Key | GIGDAWLJINYIFV-UHFFFAOYSA-N |
| Molecular Formula | C10H11BrO2 |
4-Chlorophenyl Phosphorodichloridate 97.0+%, TCI America™
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CAS: 772-79-2 Molecular Formula: C6H4Cl3O2P Molecular Weight (g/mol): 245.42 MDL Number: MFCD00009705 InChI Key: CCZMQYGSXWZFKI-UHFFFAOYSA-N Synonym: 4-chlorophenyl phosphorodichloridate,p-chlorophenyl dichlorophosphate,4-chlorophenyl dichlorophosphate,4-chlorophenylphosphorodichloridate,phosphorodichloridic acid, 4-chlorophenyl ester,4-chlorophenylphosphoryl dichloride,acmc-1bjgo,cczmqygsxwzfki-uhfffaoysa,4-chlorophenyl dichlorophosphinate,4-chlorophenyl dichloridophosphate # PubChem CID: 69879 IUPAC Name: 1-chloro-4-dichlorophosphoryloxybenzene SMILES: C1=CC(=CC=C1OP(=O)(Cl)Cl)Cl
| PubChem CID | 69879 |
|---|---|
| CAS | 772-79-2 |
| Molecular Weight (g/mol) | 245.42 |
| MDL Number | MFCD00009705 |
| SMILES | C1=CC(=CC=C1OP(=O)(Cl)Cl)Cl |
| Synonym | 4-chlorophenyl phosphorodichloridate,p-chlorophenyl dichlorophosphate,4-chlorophenyl dichlorophosphate,4-chlorophenylphosphorodichloridate,phosphorodichloridic acid, 4-chlorophenyl ester,4-chlorophenylphosphoryl dichloride,acmc-1bjgo,cczmqygsxwzfki-uhfffaoysa,4-chlorophenyl dichlorophosphinate,4-chlorophenyl dichloridophosphate # |
| IUPAC Name | 1-chloro-4-dichlorophosphoryloxybenzene |
| InChI Key | CCZMQYGSXWZFKI-UHFFFAOYSA-N |
| Molecular Formula | C6H4Cl3O2P |
2,3-Difluorophenylacetonitrile 98.0+%, TCI America™
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CAS: 145689-34-5 Molecular Formula: C8H5F2N Molecular Weight (g/mol): 153.13 MDL Number: MFCD00061277 InChI Key: IYRCHGRRMKOSHW-UHFFFAOYSA-N Synonym: 2,3-difluorophenylacetonitrile,2-2,3-difluorophenyl acetonitrile,2,3-difluorobenzyl cyanide,2,3-difluorophenylacetanitrile,benzeneacetonitrile, 2,3-difluoro,2-2,3-difluorophenyl ethanenitrile,2,3-difluorobenzeneacetonitrile,pubchem1587,acmc-209x0i,ksc183q4t PubChem CID: 518968 IUPAC Name: 2-(2,3-difluorophenyl)acetonitrile SMILES: FC1=CC=CC(CC#N)=C1F
| PubChem CID | 518968 |
|---|---|
| CAS | 145689-34-5 |
| Molecular Weight (g/mol) | 153.13 |
| MDL Number | MFCD00061277 |
| SMILES | FC1=CC=CC(CC#N)=C1F |
| Synonym | 2,3-difluorophenylacetonitrile,2-2,3-difluorophenyl acetonitrile,2,3-difluorobenzyl cyanide,2,3-difluorophenylacetanitrile,benzeneacetonitrile, 2,3-difluoro,2-2,3-difluorophenyl ethanenitrile,2,3-difluorobenzeneacetonitrile,pubchem1587,acmc-209x0i,ksc183q4t |
| IUPAC Name | 2-(2,3-difluorophenyl)acetonitrile |
| InChI Key | IYRCHGRRMKOSHW-UHFFFAOYSA-N |
| Molecular Formula | C8H5F2N |
Rebamipide 98.0+%, TCI America™
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CAS: 90098-04-7 Molecular Formula: C19H15ClN2O4 Molecular Weight (g/mol): 370.79 MDL Number: MFCD00866895,MFCD11114396 InChI Key: ALLWOAVDORUJLA-UHFFFAOYNA-N Synonym: 2-(4-Chlorobenzamido)-3-[2(1H)-quinolinon-4-yl]propionic Acid PubChem CID: 5042 IUPAC Name: 2-[(4-chlorophenyl)formamido]-3-(2-oxo-1,2-dihydroquinolin-4-yl)propanoic acid SMILES: OC(=O)C(CC1=CC(=O)NC2=CC=CC=C12)NC(=O)C1=CC=C(Cl)C=C1
| PubChem CID | 5042 |
|---|---|
| CAS | 90098-04-7 |
| Molecular Weight (g/mol) | 370.79 |
| MDL Number | MFCD00866895,MFCD11114396 |
| SMILES | OC(=O)C(CC1=CC(=O)NC2=CC=CC=C12)NC(=O)C1=CC=C(Cl)C=C1 |
| Synonym | 2-(4-Chlorobenzamido)-3-[2(1H)-quinolinon-4-yl]propionic Acid |
| IUPAC Name | 2-[(4-chlorophenyl)formamido]-3-(2-oxo-1,2-dihydroquinolin-4-yl)propanoic acid |
| InChI Key | ALLWOAVDORUJLA-UHFFFAOYNA-N |
| Molecular Formula | C19H15ClN2O4 |