1-(3-chlorophenyl)-4-[(4-methylphenyl)methyl]piperazin-4-ium

Systemtic Name: 1-(3-chlorophenyl)-4-[(4-methylphenyl)methyl]piperazin-4-ium Openeye Name: 1-(3-chlorophenyl)-4-(p-tolylmethyl)piperazin-4-ium CAS Name: 1-(3-chlorophenyl)-4-[(4-methylphenyl)methyl]piperazin-4-ium IUPAC Name: 1-(3-chlorophenyl)-4-[(4-methylphenyl)methyl]piperazin-4-ium Traditional Name: 1-(3-chlorophenyl)-4-(4-methylbenzyl)piperazin-4-ium Formula: C18H22ClN2+ MolecularWeight: 301.83368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

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