1-(3-bromophenyl)-N-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]ethanimine

Systemtic Name: 1-(3-bromophenyl)-N-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]ethanimine Openeye Name: 1-(3-bromophenyl)-N-[4-(p-tolylmethyl)piperazin-4-ium-1-yl]ethanimine CAS Name: 1-(3-bromophenyl)-N-[4-[(4-methylphenyl)methyl]-1-piperazin-4-iumyl]ethanimine IUPAC Name: 1-(3-bromophenyl)-N-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]ethanimine Traditional Name: (Z)-1-(3-bromophenyl)ethylidene-[4-(4-methylbenzyl)piperazin-4-ium-1-yl]amine Formula: C20H25BrN3+ MolecularWeight: 387.3366

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CCN(CC2)/N=C(/C)\C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H24BrN3/c1-16-6-8-18(9-7-16)15-23-10-12-24(13-11-23)22-17(2)19-4-3-5-20(21)14-19/h3-9,14H,10-13,15H2,1-2H3/p+1/b22-17-