2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-acetic acid CAS Name: 2-[4-(3-chlorophenyl)-1-piperazinyl]-2-oxoacetic acid IUPAC Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoacetic acid Traditional Name: 2-[4-(3-chlorophenyl)piperazino]-2-keto-acetic acid Formula: C12H13ClN2O3 MolecularWeight: 268.69622

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)C(=O)O

InChI

InChI=1S/C12H13ClN2O3/c13-9-2-1-3-10(8-9)14-4-6-15(7-5-14)11(16)12(17)18/h1-3,8H,4-7H2,(H,17,18)