3-[(5-oxidanylidene-4-phenyl-1,2,3,4-tetrazol-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 3-[(5-oxidanylidene-4-phenyl-1,2,3,4-tetrazol-1-yl)methyl]benzenecarbonitrile Openeye Name: 3-[(5-oxo-4-phenyl-tetrazol-1-yl)methyl]benzonitrile CAS Name: 3-[(5-oxo-4-phenyl-1-tetrazolyl)methyl]benzonitrile IUPAC Name: 3-[(5-oxo-4-phenyltetrazol-1-yl)methyl]benzonitrile Traditional Name: 3-[(5-keto-4-phenyl-tetrazol-1-yl)methyl]benzonitrile Formula: C15H11N5O MolecularWeight: 277.28074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)N(N=N2)CC3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)N(N=N2)CC3=CC=CC(=C3)C#N

InChI

InChI=1S/C15H11N5O/c16-10-12-5-4-6-13(9-12)11-19-15(21)20(18-17-19)14-7-2-1-3-8-14/h1-9H,11H2