1-[(E)-4-pyridin-1-ium-1-ylbut-2-enyl]pyridin-1-ium bromide

Systemtic Name: 1-[(E)-4-pyridin-1-ium-1-ylbut-2-enyl]pyridin-1-ium bromide Openeye Name: 1-[(E)-4-pyridin-1-ium-1-ylbut-2-enyl]pyridin-1-ium bromide CAS Name: 1-[(E)-4-(1-pyridin-1-iumyl)but-2-enyl]pyridin-1-ium bromide IUPAC Name: 1-[(E)-4-pyridin-1-ium-1-ylbut-2-enyl]pyridin-1-ium bromide Traditional Name: 1-[(E)-4-pyridin-1-ium-1-ylbut-2-enyl]pyridin-1-ium bromide Formula: C14H16BrN2+ MolecularWeight: 292.19424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CC=CC[N+]2=CC=CC=C2.[Br-]

Isomeric SMILES

C1=CC=[N+](C=C1)C/C=C/C[N+]2=CC=CC=C2.[Br-]

InChI

InChI=1S/C14H16N2.BrH/c1-3-9-15(10-4-1)13-7-8-14-16-11-5-2-6-12-16;/h1-12H,13-14H2;1H/q+2;/p-1/b8-7+;