5-[[3-[(3,4-dimethylphenyl)carbamoyl]phenyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[3-[(3,4-dimethylphenyl)carbamoyl]phenyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[3-[(3,4-dimethylphenyl)carbamoyl]anilino]-5-oxo-pentanoic acid CAS Name: 5-[3-[(3,4-dimethylanilino)-oxomethyl]anilino]-5-oxopentanoic acid IUPAC Name: 5-[3-[(3,4-dimethylphenyl)carbamoyl]anilino]-5-oxopentanoic acid Traditional Name: 5-[3-[(3,4-dimethylphenyl)carbamoyl]anilino]-5-keto-valeric acid Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)NC(=O)CCCC(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)NC(=O)CCCC(=O)O)C

InChI

InChI=1S/C20H22N2O4/c1-13-9-10-17(11-14(13)2)22-20(26)15-5-3-6-16(12-15)21-18(23)7-4-8-19(24)25/h3,5-6,9-12H,4,7-8H2,1-2H3,(H,21,23)(H,22,26)(H,24,25)