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

Systemtic Name: 1-(4-chlorophenyl)-4-[(2-methylphenyl)methyl]piperazin-4-ium Openeye Name: 1-(4-chlorophenyl)-4-(o-tolylmethyl)piperazin-4-ium CAS Name: 1-(4-chlorophenyl)-4-[(2-methylphenyl)methyl]piperazin-4-ium IUPAC Name: 1-(4-chlorophenyl)-4-[(2-methylphenyl)methyl]piperazin-4-ium Traditional Name: 1-(4-chlorophenyl)-4-(2-methylbenzyl)piperazin-4-ium Formula: C18H22ClN2+ MolecularWeight: 301.83368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCN(CC2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCN(CC2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H21ClN2/c1-15-4-2-3-5-16(15)14-20-10-12-21(13-11-20)18-8-6-17(19)7-9-18/h2-9H,10-14H2,1H3/p+1