4-[4-(3-chlorophenyl)piperazin-1-yl]benzoate

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]benzoate Openeye Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]benzoate CAS Name: 4-[4-(3-chlorophenyl)-1-piperazinyl]benzoate IUPAC Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]benzoate Traditional Name: 4-[4-(3-chlorophenyl)piperazino]benzoate Formula: C17H16ClN2O2- MolecularWeight: 315.77414

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)C(=O)[O-])C3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)C(=O)[O-])C3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H17ClN2O2/c18-14-2-1-3-16(12-14)20-10-8-19(9-11-20)15-6-4-13(5-7-15)17(21)22/h1-7,12H,8-11H2,(H,21,22)/p-1