[1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 3-acetamido-3-(4-chlorophenyl)propanoate

Systemtic Name: [1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 3-acetamido-3-(4-chlorophenyl)propanoate Openeye Name: [1-methyl-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 3-acetamido-3-(4-chlorophenyl)propanoate CAS Name: 3-acetamido-3-(4-chlorophenyl)propanoic acid [1-oxo-1-(4-phenyl-1-piperazinyl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl] 3-acetamido-3-(4-chlorophenyl)propanoate Traditional Name: 3-acetamido-3-(4-chlorophenyl)propionic acid [2-keto-1-methyl-2-(4-phenylpiperazino)ethyl] ester Formula: C24H28ClN3O4 MolecularWeight: 457.94982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)OC(=O)CC(C3=CC=C(C=C3)Cl)NC(=O)C

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)OC(=O)CC(C3=CC=C(C=C3)Cl)NC(=O)C

InChI

InChI=1S/C24H28ClN3O4/c1-17(24(31)28-14-12-27(13-15-28)21-6-4-3-5-7-21)32-23(30)16-22(26-18(2)29)19-8-10-20(25)11-9-19/h3-11,17,22H,12-16H2,1-2H3,(H,26,29)