3-[(3,5-dimethylphenyl)methyl]-4-oxidanylidene-4-phenylazanyl-butanoic acid

Systemtic Name: 3-[(3,5-dimethylphenyl)methyl]-4-oxidanylidene-4-phenylazanyl-butanoic acid Openeye Name: 4-anilino-3-[(3,5-dimethylphenyl)methyl]-4-oxo-butanoic acid CAS Name: 4-anilino-3-[(3,5-dimethylphenyl)methyl]-4-oxobutanoic acid IUPAC Name: 4-anilino-3-[(3,5-dimethylphenyl)methyl]-4-oxobutanoic acid Traditional Name: 4-anilino-3-(3,5-dimethylbenzyl)-4-keto-butyric acid Formula: C19H21NO3 MolecularWeight: 311.37494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CC(CC(=O)O)C(=O)NC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=CC(=C1)CC(CC(=O)O)C(=O)NC2=CC=CC=C2)C

InChI

InChI=1S/C19H21NO3/c1-13-8-14(2)10-15(9-13)11-16(12-18(21)22)19(23)20-17-6-4-3-5-7-17/h3-10,16H,11-12H2,1-2H3,(H,20,23)(H,21,22)