1-[2-(3-cyanopyridin-1-ium-1-yl)ethyl]pyridin-1-ium-3-carbonitrile dibromide

Systemtic Name: 1-[2-(3-cyanopyridin-1-ium-1-yl)ethyl]pyridin-1-ium-3-carbonitrile dibromide Openeye Name: 1-[2-(3-cyanopyridin-1-ium-1-yl)ethyl]pyridin-1-ium-3-carbonitrile dibromide CAS Name: 1-[2-(3-cyano-1-pyridin-1-iumyl)ethyl]-3-pyridin-1-iumcarbonitrile dibromide IUPAC Name: 1-[2-(3-cyanopyridin-1-ium-1-yl)ethyl]pyridin-1-ium-3-carbonitrile dibromide Traditional Name: 1-[2-(3-cyanopyridin-1-ium-1-yl)ethyl]pyridin-1-ium-3-carbonitrile dibromide Formula: C14H12Br2N4 MolecularWeight: 396.07988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N4.2BrH/c15-9-13-3-1-5-17(11-13)7-8-18-6-2-4-14(10-16)12-18;;/h1-6,11-12H,7-8H2;2*1H/q+2;;/p-2