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

Systemtic Name: [2-(3,4-dimethylphenyl)-2-oxidanylidene-1-phenyl-ethyl] 4-[(2,4-dimethylphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: [2-(3,4-dimethylphenyl)-2-oxo-1-phenyl-ethyl] 4-(2,4-dimethylanilino)-4-oxo-butanoate CAS Name: 4-(2,4-dimethylanilino)-4-oxobutanoic acid [2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl] 4-(2,4-dimethylanilino)-4-oxobutanoate Traditional Name: 4-(2,4-dimethylanilino)-4-keto-butyric acid [2-(3,4-dimethylphenyl)-2-keto-1-phenyl-ethyl] ester Formula: C28H29NO4 MolecularWeight: 443.53416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H29NO4/c1-18-10-13-24(21(4)16-18)29-25(30)14-15-26(31)33-28(22-8-6-5-7-9-22)27(32)23-12-11-19(2)20(3)17-23/h5-13,16-17,28H,14-15H2,1-4H3,(H,29,30)