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

Systemtic Name: 3-[[5-(4-ethylphenyl)-1,2,3,4-tetrazol-2-yl]methyl]benzenecarbonitrile Openeye Name: 3-[[5-(4-ethylphenyl)tetrazol-2-yl]methyl]benzonitrile CAS Name: 3-[[5-(4-ethylphenyl)-2-tetrazolyl]methyl]benzonitrile IUPAC Name: 3-[[5-(4-ethylphenyl)tetrazol-2-yl]methyl]benzonitrile Traditional Name: 3-[[5-(4-ethylphenyl)tetrazol-2-yl]methyl]benzonitrile Formula: C17H15N5 MolecularWeight: 289.3345

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN(N=N2)CC3=CC=CC(=C3)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN(N=N2)CC3=CC=CC(=C3)C#N

InChI

InChI=1S/C17H15N5/c1-2-13-6-8-16(9-7-13)17-19-21-22(20-17)12-15-5-3-4-14(10-15)11-18/h3-10H,2,12H2,1H3