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

Systemtic Name: 4-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]benzoic acid Openeye Name: 4-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]benzoic acid CAS Name: 4-[[4-(2-chlorophenyl)-1-piperazinyl]methyl]benzoic acid IUPAC Name: 4-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]benzoic acid Traditional Name: 4-[[4-(2-chlorophenyl)piperazino]methyl]benzoic acid Formula: C18H19ClN2O2 MolecularWeight: 330.80866

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C(=O)O)C3=CC=CC=C3Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C(=O)O)C3=CC=CC=C3Cl

InChI

InChI=1S/C18H19ClN2O2/c19-16-3-1-2-4-17(16)21-11-9-20(10-12-21)13-14-5-7-15(8-6-14)18(22)23/h1-8H,9-13H2,(H,22,23)