N-[1-[3-(dicyanomethylidene)-4H-quinoxalin-2-yl]pyridin-1-ium-3-yl]benzenecarboximidate

Systemtic Name: N-[1-[3-(dicyanomethylidene)-4H-quinoxalin-2-yl]pyridin-1-ium-3-yl]benzenecarboximidate Openeye Name: N-[1-[3-(dicyanomethylene)-4H-quinoxalin-2-yl]pyridin-1-ium-3-yl]benzenecarboximidate CAS Name: N-[1-[3-(dicyanomethylidene)-4H-quinoxalin-2-yl]-3-pyridin-1-iumyl]benzenecarboximidate IUPAC Name: N-[1-[3-(dicyanomethylidene)-4H-quinoxalin-2-yl]pyridin-1-ium-3-yl]benzenecarboximidate Traditional Name: N-[1-[3-(dicyanomethylene)-4H-quinoxalin-2-yl]pyridin-1-ium-3-yl]benzenecarboximidate Formula: C23H14N6O MolecularWeight: 390.39686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=NC2=C[N+](=CC=C2)C3=NC4=CC=CC=C4NC3=C(C#N)C#N)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=NC2=C[N+](=CC=C2)C3=NC4=CC=CC=C4NC3=C(C#N)C#N)[O-]

InChI

InChI=1S/C23H14N6O/c24-13-17(14-25)21-22(28-20-11-5-4-10-19(20)27-21)29-12-6-9-18(15-29)26-23(30)16-7-2-1-3-8-16/h1-12,15,27H