2-[5-[(4-phenylphenyl)methyl]-1,2,3,4-tetrazol-2-yl]ethanenitrile

Systemtic Name: 2-[5-[(4-phenylphenyl)methyl]-1,2,3,4-tetrazol-2-yl]ethanenitrile Openeye Name: 2-[5-[(4-phenylphenyl)methyl]tetrazol-2-yl]acetonitrile CAS Name: 2-[5-[(4-phenylphenyl)methyl]-2-tetrazolyl]acetonitrile IUPAC Name: 2-[5-[(4-phenylphenyl)methyl]tetrazol-2-yl]acetonitrile Traditional Name: 2-[5-(4-phenylbenzyl)tetrazol-2-yl]acetonitrile Formula: C16H13N5 MolecularWeight: 275.30792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)CC3=NN(N=N3)CC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)CC3=NN(N=N3)CC#N

InChI

InChI=1S/C16H13N5/c17-10-11-21-19-16(18-20-21)12-13-6-8-15(9-7-13)14-4-2-1-3-5-14/h1-9H,11-12H2