5-phenyl-6-(pyridin-1-ium-1-ylmethyl)pyrazine-2,3-dicarbonitrile

Systemtic Name: 5-phenyl-6-(pyridin-1-ium-1-ylmethyl)pyrazine-2,3-dicarbonitrile Openeye Name: 5-phenyl-6-(pyridin-1-ium-1-ylmethyl)pyrazine-2,3-dicarbonitrile CAS Name: 5-phenyl-6-(1-pyridin-1-iumylmethyl)pyrazine-2,3-dicarbonitrile IUPAC Name: 5-phenyl-6-(pyridin-1-ium-1-ylmethyl)pyrazine-2,3-dicarbonitrile Traditional Name: 5-phenyl-6-(pyridin-1-ium-1-ylmethyl)pyrazine-2,3-dicarbonitrile Formula: C18H12N5+ MolecularWeight: 298.32138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(N=C2C[N+]3=CC=CC=C3)C#N)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(N=C2C[N+]3=CC=CC=C3)C#N)C#N

InChI

InChI=1S/C18H12N5/c19-11-15-16(12-20)22-18(14-7-3-1-4-8-14)17(21-15)13-23-9-5-2-6-10-23/h1-10H,13H2/q+1