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

Systemtic Name: 1-[(4-bromophenyl)methyl]-4-(2-methylphenyl)piperazin-1-ium Openeye Name: 1-[(4-bromophenyl)methyl]-4-(o-tolyl)piperazin-1-ium CAS Name: 1-[(4-bromophenyl)methyl]-4-(2-methylphenyl)piperazin-1-ium IUPAC Name: 1-[(4-bromophenyl)methyl]-4-(2-methylphenyl)piperazin-1-ium Traditional Name: 1-(4-bromobenzyl)-4-(o-tolyl)piperazin-1-ium Formula: C18H22BrN2+ MolecularWeight: 346.28468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H21BrN2/c1-15-4-2-3-5-18(15)21-12-10-20(11-13-21)14-16-6-8-17(19)9-7-16/h2-9H,10-14H2,1H3/p+1