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

Systemtic Name: 4-[1-(1,3-benzodioxol-5-yl)-1,2,3,4-tetrazol-5-yl]benzenecarbonitrile Openeye Name: 4-[1-(1,3-benzodioxol-5-yl)tetrazol-5-yl]benzonitrile CAS Name: 4-[1-(1,3-benzodioxol-5-yl)-5-tetrazolyl]benzonitrile IUPAC Name: 4-[1-(1,3-benzodioxol-5-yl)tetrazol-5-yl]benzonitrile Traditional Name: 4-[1-(1,3-benzodioxol-5-yl)tetrazol-5-yl]benzonitrile Formula: C15H9N5O2 MolecularWeight: 291.26426

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)N3C(=NN=N3)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)N3C(=NN=N3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C15H9N5O2/c16-8-10-1-3-11(4-2-10)15-17-18-19-20(15)12-5-6-13-14(7-12)22-9-21-13/h1-7H,9H2