[2-[(3-chlorophenyl)amino]-2-oxidanylidene-ethyl] 2-(4-phenylpiperazin-1-yl)carbonylbenzoate

Systemtic Name: [2-[(3-chlorophenyl)amino]-2-oxidanylidene-ethyl] 2-(4-phenylpiperazin-1-yl)carbonylbenzoate Openeye Name: [2-(3-chloroanilino)-2-oxo-ethyl] 2-(4-phenylpiperazine-1-carbonyl)benzoate CAS Name: 2-[oxo-(4-phenyl-1-piperazinyl)methyl]benzoic acid [2-(3-chloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-chloroanilino)-2-oxoethyl] 2-(4-phenylpiperazine-1-carbonyl)benzoate Traditional Name: 2-(4-phenylpiperazine-1-carbonyl)benzoic acid [2-(3-chloroanilino)-2-keto-ethyl] ester Formula: C26H24ClN3O4 MolecularWeight: 477.93946

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC=CC=C3C(=O)OCC(=O)NC4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC=CC=C3C(=O)OCC(=O)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C26H24ClN3O4/c27-19-7-6-8-20(17-19)28-24(31)18-34-26(33)23-12-5-4-11-22(23)25(32)30-15-13-29(14-16-30)21-9-2-1-3-10-21/h1-12,17H,13-16,18H2,(H,28,31)