3-(2-methylphenyl)-2-(2H-1,2,3,4-tetrazol-5-ylmethoxy)benzenecarbonitrile

Systemtic Name: 3-(2-methylphenyl)-2-(2H-1,2,3,4-tetrazol-5-ylmethoxy)benzenecarbonitrile Openeye Name: 3-(o-tolyl)-2-(2H-tetrazol-5-ylmethoxy)benzonitrile CAS Name: 3-(2-methylphenyl)-2-(2H-tetrazol-5-ylmethoxy)benzonitrile IUPAC Name: 3-(2-methylphenyl)-2-(2H-tetrazol-5-ylmethoxy)benzonitrile Traditional Name: 3-(o-tolyl)-2-(2H-tetrazol-5-ylmethoxy)benzonitrile Formula: C16H13N5O MolecularWeight: 291.30732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC=CC(=C2OCC3=NNN=N3)C#N

Isomeric SMILES

CC1=CC=CC=C1C2=CC=CC(=C2OCC3=NNN=N3)C#N

InChI

InChI=1S/C16H13N5O/c1-11-5-2-3-7-13(11)14-8-4-6-12(9-17)16(14)22-10-15-18-20-21-19-15/h2-8H,10H2,1H3,(H,18,19,20,21)