[2-(4-acetamidophenyl)-2-oxidanylidene-ethyl] (2R)-2-(4-chlorophenyl)-3-methyl-butanoate

Systemtic Name: [2-(4-acetamidophenyl)-2-oxidanylidene-ethyl] (2R)-2-(4-chlorophenyl)-3-methyl-butanoate Openeye Name: [2-(4-acetamidophenyl)-2-oxo-ethyl] (2R)-2-(4-chlorophenyl)-3-methyl-butanoate CAS Name: (2R)-2-(4-chlorophenyl)-3-methylbutanoic acid [2-(4-acetamidophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-acetamidophenyl)-2-oxoethyl] (2R)-2-(4-chlorophenyl)-3-methylbutanoate Traditional Name: (2R)-2-(4-chlorophenyl)-3-methyl-butyric acid [2-(4-acetamidophenyl)-2-keto-ethyl] ester Formula: C21H22ClNO4 MolecularWeight: 387.85668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OCC(=O)C2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CC(C)[C@H](C1=CC=C(C=C1)Cl)C(=O)OCC(=O)C2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C21H22ClNO4/c1-13(2)20(16-4-8-17(22)9-5-16)21(26)27-12-19(25)15-6-10-18(11-7-15)23-14(3)24/h4-11,13,20H,12H2,1-3H3,(H,23,24)/t20-/m1/s1