4-[(4-chlorophenyl)carbonyl-(2,6-dimethylphenyl)amino]butanoic acid

Systemtic Name: 4-[(4-chlorophenyl)carbonyl-(2,6-dimethylphenyl)amino]butanoic acid Openeye Name: 4-(N-(4-chlorobenzoyl)-2,6-dimethyl-anilino)butanoic acid CAS Name: 4-(N-[(4-chlorophenyl)-oxomethyl]-2,6-dimethylanilino)butanoic acid IUPAC Name: 4-(N-(4-chlorobenzoyl)-2,6-dimethylanilino)butanoic acid Traditional Name: 4-(N-(4-chlorobenzoyl)-2,6-dimethyl-anilino)butyric acid Formula: C19H20ClNO3 MolecularWeight: 345.82

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N(CCCC(=O)O)C(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)C)N(CCCC(=O)O)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H20ClNO3/c1-13-5-3-6-14(2)18(13)21(12-4-7-17(22)23)19(24)15-8-10-16(20)11-9-15/h3,5-6,8-11H,4,7,12H2,1-2H3,(H,22,23)