[2-[(3-chlorophenyl)amino]-2-oxidanylidene-ethyl] (3S)-3-acetamido-3-phenyl-propanoate

Systemtic Name: [2-[(3-chlorophenyl)amino]-2-oxidanylidene-ethyl] (3S)-3-acetamido-3-phenyl-propanoate Openeye Name: [2-(3-chloroanilino)-2-oxo-ethyl] (3S)-3-acetamido-3-phenyl-propanoate CAS Name: (3S)-3-acetamido-3-phenylpropanoic acid [2-(3-chloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-chloroanilino)-2-oxoethyl] (3S)-3-acetamido-3-phenylpropanoate Traditional Name: (3S)-3-acetamido-3-phenyl-propionic acid [2-(3-chloroanilino)-2-keto-ethyl] ester Formula: C19H19ClN2O4 MolecularWeight: 374.81816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)N[C@@H](CC(=O)OCC(=O)NC1=CC(=CC=C1)Cl)C2=CC=CC=C2

InChI

InChI=1S/C19H19ClN2O4/c1-13(23)21-17(14-6-3-2-4-7-14)11-19(25)26-12-18(24)22-16-9-5-8-15(20)10-16/h2-10,17H,11-12H2,1H3,(H,21,23)(H,22,24)/t17-/m0/s1