[2-(3,4-dimethylphenyl)-2-oxidanylidene-1-phenyl-ethyl] 4-[(4-methoxyphenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: [2-(3,4-dimethylphenyl)-2-oxidanylidene-1-phenyl-ethyl] 4-[(4-methoxyphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: [2-(3,4-dimethylphenyl)-2-oxo-1-phenyl-ethyl] 4-(4-methoxyanilino)-4-oxo-butanoate CAS Name: 4-(4-methoxyanilino)-4-oxobutanoic acid [2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl] 4-(4-methoxyanilino)-4-oxobutanoate Traditional Name: 4-keto-4-(p-anisidino)butyric acid [2-(3,4-dimethylphenyl)-2-keto-1-phenyl-ethyl] ester Formula: C27H27NO5 MolecularWeight: 445.50698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C(C2=CC=CC=C2)OC(=O)CCC(=O)NC3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C(C2=CC=CC=C2)OC(=O)CCC(=O)NC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C27H27NO5/c1-18-9-10-21(17-19(18)2)26(31)27(20-7-5-4-6-8-20)33-25(30)16-15-24(29)28-22-11-13-23(32-3)14-12-22/h4-14,17,27H,15-16H2,1-3H3,(H,28,29)