2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanenitrile

Systemtic Name: 2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanenitrile Openeye Name: 2-(4-oxo-1,2,3-benzotriazin-3-yl)acetonitrile CAS Name: 2-(4-oxo-1,2,3-benzotriazin-3-yl)acetonitrile IUPAC Name: 2-(4-oxo-1,2,3-benzotriazin-3-yl)acetonitrile Traditional Name: 2-(4-keto-1,2,3-benzotriazin-3-yl)acetonitrile Formula: C9H6N4O MolecularWeight: 186.17014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CC#N

InChI

InChI=1S/C9H6N4O/c10-5-6-13-9(14)7-3-1-2-4-8(7)11-12-13/h1-4H,6H2