7-[5-(4-phenylphenyl)-1,2,3,4-tetrazol-2-yl]heptanenitrile

Systemtic Name: 7-[5-(4-phenylphenyl)-1,2,3,4-tetrazol-2-yl]heptanenitrile Openeye Name: 7-[5-(4-phenylphenyl)tetrazol-2-yl]heptanenitrile CAS Name: 7-[5-(4-phenylphenyl)-2-tetrazolyl]heptanenitrile IUPAC Name: 7-[5-(4-phenylphenyl)tetrazol-2-yl]heptanenitrile Traditional Name: 7-[5-(4-phenylphenyl)tetrazol-2-yl]enanthonitrile Formula: C20H21N5 MolecularWeight: 331.41424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NN(N=N3)CCCCCCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NN(N=N3)CCCCCCC#N

InChI

InChI=1S/C20H21N5/c21-15-7-2-1-3-8-16-25-23-20(22-24-25)19-13-11-18(12-14-19)17-9-5-4-6-10-17/h4-6,9-14H,1-3,7-8,16H2