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

Systemtic Name: [2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] (2R)-2-[(4-ethoxyphenyl)amino]-4-oxidanylidene-4-phenyl-butanoate Openeye Name: [2-(3,4-dimethylphenyl)-2-oxo-ethyl] (2R)-2-(4-ethoxyanilino)-4-oxo-4-phenyl-butanoate CAS Name: (2R)-2-(4-ethoxyanilino)-4-oxo-4-phenylbutanoic acid [2-(3,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylphenyl)-2-oxoethyl] (2R)-2-(4-ethoxyanilino)-4-oxo-4-phenylbutanoate Traditional Name: (2R)-4-keto-4-phenyl-2-(p-phenetidino)butyric acid [2-(3,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C28H29NO5 MolecularWeight: 459.53356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(CC(=O)C2=CC=CC=C2)C(=O)OCC(=O)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N[C@H](CC(=O)C2=CC=CC=C2)C(=O)OCC(=O)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C28H29NO5/c1-4-33-24-14-12-23(13-15-24)29-25(17-26(30)21-8-6-5-7-9-21)28(32)34-18-27(31)22-11-10-19(2)20(3)16-22/h5-16,25,29H,4,17-18H2,1-3H3/t25-/m1/s1