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

Systemtic Name: 4-[2-(5-oxidanylidene-4-phenyl-1,2,3,4-tetrazol-1-yl)ethoxy]benzenecarbonitrile Openeye Name: 4-[2-(5-oxo-4-phenyl-tetrazol-1-yl)ethoxy]benzonitrile CAS Name: 4-[2-(5-oxo-4-phenyl-1-tetrazolyl)ethoxy]benzonitrile IUPAC Name: 4-[2-(5-oxo-4-phenyltetrazol-1-yl)ethoxy]benzonitrile Traditional Name: 4-[2-(5-keto-4-phenyl-tetrazol-1-yl)ethoxy]benzonitrile Formula: C16H13N5O2 MolecularWeight: 307.30672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)N(N=N2)CCOC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)N(N=N2)CCOC3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H13N5O2/c17-12-13-6-8-15(9-7-13)23-11-10-20-16(22)21(19-18-20)14-4-2-1-3-5-14/h1-9H,10-11H2