1-[(4-bromophenyl)methyl]-N-pyridin-1-ium-1-yl-pyrazin-2-imine

Systemtic Name: 1-[(4-bromophenyl)methyl]-N-pyridin-1-ium-1-yl-pyrazin-2-imine Openeye Name: 1-[(4-bromophenyl)methyl]-N-pyridin-1-ium-1-yl-pyrazin-2-imine CAS Name: 1-[(4-bromophenyl)methyl]-N-(1-pyridin-1-iumyl)-2-pyrazinimine IUPAC Name: 1-[(4-bromophenyl)methyl]-N-pyridin-1-ium-1-ylpyrazin-2-imine Traditional Name: (E)-[1-(4-bromobenzyl)pyrazin-2-ylidene]-pyridin-1-ium-1-yl-amine Formula: C16H14BrN4+ MolecularWeight: 342.21316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)N=C2C=NC=CN2CC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=[N+](C=C1)/N=C/2\C=NC=CN2CC3=CC=C(C=C3)Br

InChI

InChI=1S/C16H14BrN4/c17-15-6-4-14(5-7-15)13-20-11-8-18-12-16(20)19-21-9-2-1-3-10-21/h1-12H,13H2/q+1/b19-16+