(3R,4R)-4-(4-dimethylaminophenyl)-6-oxidanyl-2-oxidanylidene-3-pyridin-1-ium-1-yl-3,4-dihydro-1H-pyridine-5-carbonitrile

Systemtic Name: (3R,4R)-4-(4-dimethylaminophenyl)-6-oxidanyl-2-oxidanylidene-3-pyridin-1-ium-1-yl-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: (3R,4R)-4-(4-dimethylaminophenyl)-6-hydroxy-2-oxo-3-pyridin-1-ium-1-yl-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: (3R,4R)-4-(4-dimethylaminophenyl)-6-hydroxy-2-oxo-3-(1-pyridin-1-iumyl)-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: (3R,4R)-4-(4-dimethylaminophenyl)-6-hydroxy-2-oxo-3-pyridin-1-ium-1-yl-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: (3R,4R)-4-(4-dimethylaminophenyl)-6-hydroxy-2-keto-3-pyridin-1-ium-1-yl-3,4-dihydro-1H-pyridine-5-carbonitrile Formula: C19H19N4O2+ MolecularWeight: 335.37976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N4O2/c1-22(2)14-8-6-13(7-9-14)16-15(12-20)18(24)21-19(25)17(16)23-10-4-3-5-11-23/h3-11,16-17H,1-2H3,(H-,21,24,25)/p+1/t16-,17-/m1/s1