1-[(2-bromophenyl)methyl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[(2-bromophenyl)methyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[(2-bromophenyl)methyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[(2-bromophenyl)methyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[(2-bromophenyl)methyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-(2-bromobenzyl)-4-methyl-piperazine-1,4-diium Formula: C12H19BrN2+2 MolecularWeight: 271.19666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CC2=CC=CC=C2Br

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CC2=CC=CC=C2Br

InChI

InChI=1S/C12H17BrN2/c1-14-6-8-15(9-7-14)10-11-4-2-3-5-12(11)13/h2-5H,6-10H2,1H3/p+2