2-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-(4-chlorobenzoyl)piperazin-1-yl]-2-oxo-acetic acid CAS Name: 2-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]-2-oxoacetic acid IUPAC Name: 2-[4-(4-chlorobenzoyl)piperazin-1-yl]-2-oxoacetic acid Traditional Name: 2-[4-(4-chlorobenzoyl)piperazino]-2-keto-acetic acid Formula: C13H13ClN2O4 MolecularWeight: 296.70632

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)Cl)C(=O)C(=O)O

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)Cl)C(=O)C(=O)O

InChI

InChI=1S/C13H13ClN2O4/c14-10-3-1-9(2-4-10)11(17)15-5-7-16(8-6-15)12(18)13(19)20/h1-4H,5-8H2,(H,19,20)