4-[(3,4-dimethylphenyl)amino]-2-[(3-methylphenyl)methyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3,4-dimethylphenyl)amino]-2-[(3-methylphenyl)methyl]-4-oxidanylidene-butanoic acid Openeye Name: 4-(3,4-dimethylanilino)-2-(m-tolylmethyl)-4-oxo-butanoic acid CAS Name: 4-(3,4-dimethylanilino)-2-[(3-methylphenyl)methyl]-4-oxobutanoic acid IUPAC Name: 4-(3,4-dimethylanilino)-2-[(3-methylphenyl)methyl]-4-oxobutanoic acid Traditional Name: 4-(3,4-dimethylanilino)-4-keto-2-(3-methylbenzyl)butyric acid Formula: C20H23NO3 MolecularWeight: 325.40152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23NO3/c1-13-5-4-6-16(9-13)11-17(20(23)24)12-19(22)21-18-8-7-14(2)15(3)10-18/h4-10,17H,11-12H2,1-3H3,(H,21,22)(H,23,24)