(3R,4S)-5-cyano-2-oxidanylidene-4-phenyl-3-(4-pyridin-4-ylpyridin-1-ium-1-yl)-3,4-dihydro-1H-pyridin-6-olate

Systemtic Name: (3R,4S)-5-cyano-2-oxidanylidene-4-phenyl-3-(4-pyridin-4-ylpyridin-1-ium-1-yl)-3,4-dihydro-1H-pyridin-6-olate Openeye Name: (3R,4S)-5-cyano-2-oxo-4-phenyl-3-[4-(4-pyridyl)pyridin-1-ium-1-yl]-3,4-dihydro-1H-pyridin-6-olate CAS Name: (3R,4S)-5-cyano-2-oxo-4-phenyl-3-(4-pyridin-4-yl-1-pyridin-1-iumyl)-3,4-dihydro-1H-pyridin-6-olate IUPAC Name: (3R,4S)-5-cyano-2-oxo-4-phenyl-3-(4-pyridin-4-ylpyridin-1-ium-1-yl)-3,4-dihydro-1H-pyridin-6-olate Traditional Name: (3R,4S)-5-cyano-2-keto-4-phenyl-3-[4-(4-pyridyl)pyridin-1-ium-1-yl]-3,4-dihydro-1H-pyridin-6-olate Formula: C22H16N4O2 MolecularWeight: 368.38804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(C(=O)NC(=C2C#N)[O-])[N+]3=CC=C(C=C3)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)[C@@H]2[C@H](C(=O)NC(=C2C#N)[O-])[N+]3=CC=C(C=C3)C4=CC=NC=C4

InChI

InChI=1S/C22H16N4O2/c23-14-18-19(17-4-2-1-3-5-17)20(22(28)25-21(18)27)26-12-8-16(9-13-26)15-6-10-24-11-7-15/h1-13,19-20H,(H-,25,27,28)/t19-,20+/m0/s1