3-(3-oxidanylidene-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-2-yl)propanenitrile

Systemtic Name: 3-(3-oxidanylidene-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-2-yl)propanenitrile Openeye Name: 3-(3-oxo-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-2-yl)propanenitrile CAS Name: 3-(3-oxo-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-2-yl)propanenitrile IUPAC Name: 3-(3-oxo-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-2-yl)propanenitrile Traditional Name: 3-(3-keto-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-2-yl)propionitrile Formula: C9H9N4O+ MolecularWeight: 189.19396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8N4O/c10-5-3-7-13-9(14)12-6-2-1-4-8(12)11-13/h1-2,4,6H,3,7H2/p+1