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

Systemtic Name: 4-[2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]ethyl]benzoic acid Openeye Name: 4-[2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]ethyl]benzoic acid CAS Name: 4-[2-[4-[(3-chlorophenyl)methyl]-1-piperazinyl]ethyl]benzoic acid IUPAC Name: 4-[2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]ethyl]benzoic acid Traditional Name: 4-[2-[4-(3-chlorobenzyl)piperazino]ethyl]benzoic acid Formula: C20H23ClN2O2 MolecularWeight: 358.86182

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=C(C=C2)C(=O)O)CC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CCN1CCC2=CC=C(C=C2)C(=O)O)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H23ClN2O2/c21-19-3-1-2-17(14-19)15-23-12-10-22(11-13-23)9-8-16-4-6-18(7-5-16)20(24)25/h1-7,14H,8-13,15H2,(H,24,25)