1-[(3-bromophenyl)methyl]-4-(4-methylcyclohexyl)piperazine-1,4-diium

Systemtic Name: 1-[(3-bromophenyl)methyl]-4-(4-methylcyclohexyl)piperazine-1,4-diium Openeye Name: 1-[(3-bromophenyl)methyl]-4-(4-methylcyclohexyl)piperazine-1,4-diium CAS Name: 1-[(3-bromophenyl)methyl]-4-(4-methylcyclohexyl)piperazine-1,4-diium IUPAC Name: 1-[(3-bromophenyl)methyl]-4-(4-methylcyclohexyl)piperazine-1,4-diium Traditional Name: 1-(3-bromobenzyl)-4-(4-methylcyclohexyl)piperazine-1,4-diium Formula: C18H29BrN2+2 MolecularWeight: 353.34026

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)[NH+]2CC[NH+](CC2)CC3=CC(=CC=C3)Br

Isomeric SMILES

CC1CCC(CC1)[NH+]2CC[NH+](CC2)CC3=CC(=CC=C3)Br

InChI

InChI=1S/C18H27BrN2/c1-15-5-7-18(8-6-15)21-11-9-20(10-12-21)14-16-3-2-4-17(19)13-16/h2-4,13,15,18H,5-12,14H2,1H3/p+2