1-butyl-4-pyridin-1-ium-4-yl-pyridin-1-ium dibromide

Systemtic Name: 1-butyl-4-pyridin-1-ium-4-yl-pyridin-1-ium dibromide Openeye Name: 1-butyl-4-pyridin-1-ium-4-yl-pyridin-1-ium dibromide CAS Name: 1-butyl-4-(4-pyridin-1-iumyl)pyridin-1-ium dibromide IUPAC Name: 1-butyl-4-pyridin-1-ium-4-ylpyridin-1-ium dibromide Traditional Name: 1-butyl-4-pyridin-1-ium-4-yl-pyridin-1-ium dibromide Formula: C14H18Br2N2 MolecularWeight: 374.11412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=CC=C(C=C1)C2=CC=[NH+]C=C2.[Br-].[Br-]

Isomeric SMILES

CCCC[N+]1=CC=C(C=C1)C2=CC=[NH+]C=C2.[Br-].[Br-]

InChI

InChI=1S/C14H17N2.2BrH/c1-2-3-10-16-11-6-14(7-12-16)13-4-8-15-9-5-13;;/h4-9,11-12H,2-3,10H2,1H3;2*1H/q+1;;/p-1