3-[(E)-2H-1,2,3,4-tetrazol-5-yliminomethyl]benzenecarbonitrile

Systemtic Name: 3-[(E)-2H-1,2,3,4-tetrazol-5-yliminomethyl]benzenecarbonitrile Openeye Name: 3-[(E)-2H-tetrazol-5-yliminomethyl]benzonitrile CAS Name: 3-[(E)-2H-tetrazol-5-yliminomethyl]benzonitrile IUPAC Name: 3-[(E)-2H-tetrazol-5-yliminomethyl]benzonitrile Traditional Name: 3-[(E)-2H-tetrazol-5-yliminomethyl]benzonitrile Formula: C9H6N6 MolecularWeight: 198.18414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C=NC2=NNN=N2)C#N

Isomeric SMILES

C1=CC(=CC(=C1)/C=N/C2=NNN=N2)C#N

InChI

InChI=1S/C9H6N6/c10-5-7-2-1-3-8(4-7)6-11-9-12-14-15-13-9/h1-4,6H,(H,12,13,14,15)/b11-6+