1-[[2-(4-chlorophenyl)phenyl]methyl]piperazin-1-ium chloride

Systemtic Name: 1-[[2-(4-chlorophenyl)phenyl]methyl]piperazin-1-ium chloride Openeye Name: 1-[[2-(4-chlorophenyl)phenyl]methyl]piperazin-1-ium chloride CAS Name: 1-[[2-(4-chlorophenyl)phenyl]methyl]piperazin-1-ium chloride IUPAC Name: 1-[[2-(4-chlorophenyl)phenyl]methyl]piperazin-1-ium chloride Traditional Name: 1-[2-(4-chlorophenyl)benzyl]piperazin-1-ium chloride Formula: C17H20Cl2N2 MolecularWeight: 323.2601

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCN1)CC2=CC=CC=C2C3=CC=C(C=C3)Cl.[Cl-]

Isomeric SMILES

C1C[NH+](CCN1)CC2=CC=CC=C2C3=CC=C(C=C3)Cl.[Cl-]

InChI

InChI=1S/C17H19ClN2.ClH/c18-16-7-5-14(6-8-16)17-4-2-1-3-15(17)13-20-11-9-19-10-12-20;/h1-8,19H,9-13H2;1H