2-(dimethylamino)-5-(1-oxidanidylpyridin-1-ium-4-yl)pyridine-3-carbonitrile

Systemtic Name: 2-(dimethylamino)-5-(1-oxidanidylpyridin-1-ium-4-yl)pyridine-3-carbonitrile Openeye Name: 2-(dimethylamino)-5-(1-oxidopyridin-1-ium-4-yl)pyridine-3-carbonitrile CAS Name: 2-(dimethylamino)-5-(1-oxido-4-pyridin-1-iumyl)-3-pyridinecarbonitrile IUPAC Name: 2-(dimethylamino)-5-(1-oxidopyridin-1-ium-4-yl)pyridine-3-carbonitrile Traditional Name: 2-(dimethylamino)-5-(1-oxidopyridin-1-ium-4-yl)nicotinonitrile Formula: C13H12N4O MolecularWeight: 240.26058

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=C(C=C1C#N)C2=CC=[N+](C=C2)[O-]

Isomeric SMILES

CN(C)C1=NC=C(C=C1C#N)C2=CC=[N+](C=C2)[O-]

InChI

InChI=1S/C13H12N4O/c1-16(2)13-11(8-14)7-12(9-15-13)10-3-5-17(18)6-4-10/h3-7,9H,1-2H3