3-(5-pyridin-2-yl-1,2,3,4-tetrazol-1-yl)benzenecarbonitrile

Systemtic Name: 3-(5-pyridin-2-yl-1,2,3,4-tetrazol-1-yl)benzenecarbonitrile Openeye Name: 3-[5-(2-pyridyl)tetrazol-1-yl]benzonitrile CAS Name: 3-[5-(2-pyridinyl)-1-tetrazolyl]benzonitrile IUPAC Name: 3-(5-pyridin-2-yltetrazol-1-yl)benzonitrile Traditional Name: 3-[5-(2-pyridyl)tetrazol-1-yl]benzonitrile Formula: C13H8N6 MolecularWeight: 248.24282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=NN=NN2C3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=NC(=C1)C2=NN=NN2C3=CC=CC(=C3)C#N

InChI

InChI=1S/C13H8N6/c14-9-10-4-3-5-11(8-10)19-13(16-17-18-19)12-6-1-2-7-15-12/h1-8H