4-(5-oxidanylidene-2H-1,2,3-triazol-1-yl)benzenecarbonitrile

Systemtic Name: 4-(5-oxidanylidene-2H-1,2,3-triazol-1-yl)benzenecarbonitrile Openeye Name: 4-(5-oxo-2H-triazol-1-yl)benzonitrile CAS Name: 4-(5-oxo-2H-triazol-1-yl)benzonitrile IUPAC Name: 4-(5-oxo-2H-triazol-1-yl)benzonitrile Traditional Name: 4-(5-keto-2H-triazol-1-yl)benzonitrile Formula: C9H6N4O MolecularWeight: 186.17014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)N2C(=O)C=NN2

Isomeric SMILES

C1=CC(=CC=C1C#N)N2C(=O)C=NN2

InChI

InChI=1S/C9H6N4O/c10-5-7-1-3-8(4-2-7)13-9(14)6-11-12-13/h1-4,6,12H