[(2R)-1-[(4-acetamidophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(3,4-dimethylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: [(2R)-1-[(4-acetamidophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(3,4-dimethylphenyl)-4-oxidanylidene-butanoate Openeye Name: [(1R)-2-(4-acetamidoanilino)-1-methyl-2-oxo-ethyl] 4-(3,4-dimethylphenyl)-4-oxo-butanoate CAS Name: 4-(3,4-dimethylphenyl)-4-oxobutanoic acid [(2R)-1-(4-acetamidoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-acetamidoanilino)-1-oxopropan-2-yl] 4-(3,4-dimethylphenyl)-4-oxobutanoate Traditional Name: 4-(3,4-dimethylphenyl)-4-keto-butyric acid [(1R)-2-(4-acetamidoanilino)-2-keto-1-methyl-ethyl] ester Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CCC(=O)O[C@H](C)C(=O)NC2=CC=C(C=C2)NC(=O)C)C

InChI

InChI=1S/C23H26N2O5/c1-14-5-6-18(13-15(14)2)21(27)11-12-22(28)30-16(3)23(29)25-20-9-7-19(8-10-20)24-17(4)26/h5-10,13,16H,11-12H2,1-4H3,(H,24,26)(H,25,29)/t16-/m1/s1