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

Systemtic Name: 3-[5-(4-phenylmethoxyphenyl)-1,2,3,4-tetrazol-2-yl]propanenitrile Openeye Name: 3-[5-(4-benzyloxyphenyl)tetrazol-2-yl]propanenitrile CAS Name: 3-[5-(4-phenylmethoxyphenyl)-2-tetrazolyl]propanenitrile IUPAC Name: 3-[5-(4-phenylmethoxyphenyl)tetrazol-2-yl]propanenitrile Traditional Name: 3-[5-(4-benzoxyphenyl)tetrazol-2-yl]propionitrile Formula: C17H15N5O MolecularWeight: 305.3339

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NN(N=N3)CCC#N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NN(N=N3)CCC#N

InChI

InChI=1S/C17H15N5O/c18-11-4-12-22-20-17(19-21-22)15-7-9-16(10-8-15)23-13-14-5-2-1-3-6-14/h1-3,5-10H,4,12-13H2