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

Systemtic Name: 2-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]iminomethyl]benzoic acid Openeye Name: 2-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]iminomethyl]benzoic acid CAS Name: 2-[[4-[(2-chlorophenyl)methyl]-1-piperazinyl]iminomethyl]benzoic acid IUPAC Name: 2-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]iminomethyl]benzoic acid Traditional Name: 2-[[4-(2-chlorobenzyl)piperazino]iminomethyl]benzoic acid Formula: C19H20ClN3O2 MolecularWeight: 357.834

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2Cl)N=CC3=CC=CC=C3C(=O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2Cl)N=CC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C19H20ClN3O2/c20-18-8-4-2-6-16(18)14-22-9-11-23(12-10-22)21-13-15-5-1-3-7-17(15)19(24)25/h1-8,13H,9-12,14H2,(H,24,25)