(1E)-3,4,4-tricyano-1-phenyl-2-pyridin-1-ium-1-yl-buta-1,3-dien-1-olate

Systemtic Name: (1E)-3,4,4-tricyano-1-phenyl-2-pyridin-1-ium-1-yl-buta-1,3-dien-1-olate Openeye Name: (1E)-3,4,4-tricyano-1-phenyl-2-pyridin-1-ium-1-yl-buta-1,3-dien-1-olate CAS Name: (1E)-3,4,4-tricyano-1-phenyl-2-(1-pyridin-1-iumyl)-1-buta-1,3-dienolate IUPAC Name: (1E)-3,4,4-tricyano-1-phenyl-2-pyridin-1-ium-1-ylbuta-1,3-dien-1-olate Traditional Name: (1E)-3,4,4-tricyano-1-phenyl-2-pyridin-1-ium-1-yl-buta-1,3-dien-1-olate Formula: C18H10N4O MolecularWeight: 298.2982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)/C(=C(/C(=C(C#N)C#N)C#N)\[N+]2=CC=CC=C2)/[O-]

InChI

InChI=1S/C18H10N4O/c19-11-15(12-20)16(13-21)17(22-9-5-2-6-10-22)18(23)14-7-3-1-4-8-14/h1-10H/b18-17+