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

Systemtic Name: [2-[(3,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 3-acetamido-3-(4-chlorophenyl)propanoate Openeye Name: [2-(3,5-dimethoxyanilino)-2-oxo-ethyl] 3-acetamido-3-(4-chlorophenyl)propanoate CAS Name: 3-acetamido-3-(4-chlorophenyl)propanoic acid [2-(3,5-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethoxyanilino)-2-oxoethyl] 3-acetamido-3-(4-chlorophenyl)propanoate Traditional Name: 3-acetamido-3-(4-chlorophenyl)propionic acid [2-(3,5-dimethoxyanilino)-2-keto-ethyl] ester Formula: C21H23ClN2O6 MolecularWeight: 434.87012

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)OCC(=O)NC1=CC(=CC(=C1)OC)OC)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(=O)NC(CC(=O)OCC(=O)NC1=CC(=CC(=C1)OC)OC)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H23ClN2O6/c1-13(25)23-19(14-4-6-15(22)7-5-14)11-21(27)30-12-20(26)24-16-8-17(28-2)10-18(9-16)29-3/h4-10,19H,11-12H2,1-3H3,(H,23,25)(H,24,26)