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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C(=C(C=C2)C#N)OC)C3=NNN=N3

Isomeric SMILES

CC1=CC=CC=C1C2=C(C(=C(C=C2)C#N)OC)C3=NNN=N3

InChI

InChI=1S/C16H13N5O/c1-10-5-3-4-6-12(10)13-8-7-11(9-17)15(22-2)14(13)16-18-20-21-19-16/h3-8H,1-2H3,(H,18,19,20,21)