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

Systemtic Name: 2-[4-[(2-bromophenyl)methyl]piperazin-4-ium-1-yl]pyrazine Openeye Name: 2-[4-[(2-bromophenyl)methyl]piperazin-4-ium-1-yl]pyrazine CAS Name: 2-[4-[(2-bromophenyl)methyl]-1-piperazin-4-iumyl]pyrazine IUPAC Name: 2-[4-[(2-bromophenyl)methyl]piperazin-4-ium-1-yl]pyrazine Traditional Name: 2-[4-(2-bromobenzyl)piperazin-4-ium-1-yl]pyrazine Formula: C15H18BrN4+ MolecularWeight: 334.23422

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2Br)C3=NC=CN=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2Br)C3=NC=CN=C3

InChI

InChI=1S/C15H17BrN4/c16-14-4-2-1-3-13(14)12-19-7-9-20(10-8-19)15-11-17-5-6-18-15/h1-6,11H,7-10,12H2/p+1