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

Systemtic Name: 3-[(3,5-dimethylphenyl)methyl]-4-[(4-methoxyphenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[(3,5-dimethylphenyl)methyl]-4-(4-methoxyanilino)-4-oxo-butanoic acid CAS Name: 3-[(3,5-dimethylphenyl)methyl]-4-(4-methoxyanilino)-4-oxobutanoic acid IUPAC Name: 3-[(3,5-dimethylphenyl)methyl]-4-(4-methoxyanilino)-4-oxobutanoic acid Traditional Name: 3-(3,5-dimethylbenzyl)-4-keto-4-(p-anisidino)butyric acid Formula: C20H23NO4 MolecularWeight: 341.40092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23NO4/c1-13-8-14(2)10-15(9-13)11-16(12-19(22)23)20(24)21-17-4-6-18(25-3)7-5-17/h4-10,16H,11-12H2,1-3H3,(H,21,24)(H,22,23)