[2-[(3,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 4-(4-chlorophenyl)-4-oxidanylidene-butanoate

Systemtic Name: [2-[(3,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 4-(4-chlorophenyl)-4-oxidanylidene-butanoate Openeye Name: [2-(3,5-dimethoxyanilino)-2-oxo-ethyl] 4-(4-chlorophenyl)-4-oxo-butanoate CAS Name: 4-(4-chlorophenyl)-4-oxobutanoic acid [2-(3,5-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethoxyanilino)-2-oxoethyl] 4-(4-chlorophenyl)-4-oxobutanoate Traditional Name: 4-(4-chlorophenyl)-4-keto-butyric acid [2-(3,5-dimethoxyanilino)-2-keto-ethyl] ester Formula: C20H20ClNO6 MolecularWeight: 405.8289

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)COC(=O)CCC(=O)C2=CC=C(C=C2)Cl)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)COC(=O)CCC(=O)C2=CC=C(C=C2)Cl)OC

InChI

InChI=1S/C20H20ClNO6/c1-26-16-9-15(10-17(11-16)27-2)22-19(24)12-28-20(25)8-7-18(23)13-3-5-14(21)6-4-13/h3-6,9-11H,7-8,12H2,1-2H3,(H,22,24)