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

Systemtic Name: 3-[5-(4-methylphenyl)-1,2,3,4-tetrazol-2-yl]propanenitrile Openeye Name: 3-[5-(p-tolyl)tetrazol-2-yl]propanenitrile CAS Name: 3-[5-(4-methylphenyl)-2-tetrazolyl]propanenitrile IUPAC Name: 3-[5-(4-methylphenyl)tetrazol-2-yl]propanenitrile Traditional Name: 3-[5-(p-tolyl)tetrazol-2-yl]propionitrile Formula: C11H11N5 MolecularWeight: 213.23854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(N=N2)CCC#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(N=N2)CCC#N

InChI

InChI=1S/C11H11N5/c1-9-3-5-10(6-4-9)11-13-15-16(14-11)8-2-7-12/h3-6H,2,8H2,1H3