2-(3-pyridin-1-ium-1-yl-1H-quinoxalin-2-ylidene)propanedinitrile

Systemtic Name: 2-(3-pyridin-1-ium-1-yl-1H-quinoxalin-2-ylidene)propanedinitrile Openeye Name: 2-(3-pyridin-1-ium-1-yl-1H-quinoxalin-2-ylidene)propanedinitrile CAS Name: 2-[3-(1-pyridin-1-iumyl)-1H-quinoxalin-2-ylidene]propanedinitrile IUPAC Name: 2-(3-pyridin-1-ium-1-yl-1H-quinoxalin-2-ylidene)propanedinitrile Traditional Name: 2-(3-pyridin-1-ium-1-yl-1H-quinoxalin-2-ylidene)malononitrile Formula: C16H10N5+ MolecularWeight: 272.2841

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)C2=NC3=CC=CC=C3NC2=C(C#N)C#N

Isomeric SMILES

C1=CC=[N+](C=C1)C2=NC3=CC=CC=C3NC2=C(C#N)C#N

InChI

InChI=1S/C16H10N5/c17-10-12(11-18)15-16(21-8-4-1-5-9-21)20-14-7-3-2-6-13(14)19-15/h1-9,19H/q+1