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

Systemtic Name: 4-[[5-(2-methylphenyl)-1,2,3,4-tetrazol-2-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-(o-tolyl)tetrazol-2-yl]methyl]benzonitrile CAS Name: 4-[[5-(2-methylphenyl)-2-tetrazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-(2-methylphenyl)tetrazol-2-yl]methyl]benzonitrile Traditional Name: 4-[[5-(o-tolyl)tetrazol-2-yl]methyl]benzonitrile Formula: C16H13N5 MolecularWeight: 275.30792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN(N=N2)CC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC=CC=C1C2=NN(N=N2)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H13N5/c1-12-4-2-3-5-15(12)16-18-20-21(19-16)11-14-8-6-13(10-17)7-9-14/h2-9H,11H2,1H3