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

Systemtic Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]benzoic acid Openeye Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]benzoic acid CAS Name: 2-[4-(3-chlorophenyl)-1-piperazinyl]benzoic acid IUPAC Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]benzoic acid Traditional Name: 2-[4-(3-chlorophenyl)piperazino]benzoic acid Formula: C17H17ClN2O2 MolecularWeight: 316.78208

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=CC=CC=C3C(=O)O

InChI

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