5-cyano-4-(4-methylphenyl)-2-oxidanylidene-3-pyridin-1-ium-1-yl-3,4-dihydro-1H-pyridin-6-olate

Systemtic Name: 5-cyano-4-(4-methylphenyl)-2-oxidanylidene-3-pyridin-1-ium-1-yl-3,4-dihydro-1H-pyridin-6-olate Openeye Name: 5-cyano-2-oxo-4-(p-tolyl)-3-pyridin-1-ium-1-yl-3,4-dihydro-1H-pyridin-6-olate CAS Name: 5-cyano-4-(4-methylphenyl)-2-oxo-3-(1-pyridin-1-iumyl)-3,4-dihydro-1H-pyridin-6-olate IUPAC Name: 5-cyano-4-(4-methylphenyl)-2-oxo-3-pyridin-1-ium-1-yl-3,4-dihydro-1H-pyridin-6-olate Traditional Name: 5-cyano-2-keto-4-(p-tolyl)-3-pyridin-1-ium-1-yl-3,4-dihydro-1H-pyridin-6-olate Formula: C18H15N3O2 MolecularWeight: 305.3306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(C(=O)NC(=C2C#N)[O-])[N+]3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2C(C(=O)NC(=C2C#N)[O-])[N+]3=CC=CC=C3

InChI

InChI=1S/C18H15N3O2/c1-12-5-7-13(8-6-12)15-14(11-19)17(22)20-18(23)16(15)21-9-3-2-4-10-21/h2-10,15-16H,1H3,(H-,20,22,23)