1-octyl-2-pyridin-2-yl-pyridin-1-ium bromide

Systemtic Name: 1-octyl-2-pyridin-2-yl-pyridin-1-ium bromide Openeye Name: 1-octyl-2-(2-pyridyl)pyridin-1-ium bromide CAS Name: 1-octyl-2-(2-pyridinyl)pyridin-1-ium bromide IUPAC Name: 1-octyl-2-pyridin-2-ylpyridin-1-ium bromide Traditional Name: 1-octyl-2-(2-pyridyl)pyridin-1-ium bromide Formula: C18H25BrN2 MolecularWeight: 349.3085

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+]1=CC=CC=C1C2=CC=CC=N2.[Br-]

Isomeric SMILES

CCCCCCCC[N+]1=CC=CC=C1C2=CC=CC=N2.[Br-]

InChI

InChI=1S/C18H25N2.BrH/c1-2-3-4-5-6-10-15-20-16-11-8-13-18(20)17-12-7-9-14-19-17;/h7-9,11-14,16H,2-6,10,15H2,1H3;1H/q+1;/p-1