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

Systemtic Name: 3-[5-(5-fluoranylpyridin-2-yl)-1,2,3,4-tetrazol-2-yl]-5-iodanyl-benzenecarbonitrile Openeye Name: 3-[5-(5-fluoro-2-pyridyl)tetrazol-2-yl]-5-iodo-benzonitrile CAS Name: 3-[5-(5-fluoro-2-pyridinyl)-2-tetrazolyl]-5-iodobenzonitrile IUPAC Name: 3-[5-(5-fluoropyridin-2-yl)tetrazol-2-yl]-5-iodobenzonitrile Traditional Name: 3-[5-(5-fluoro-2-pyridyl)tetrazol-2-yl]-5-iodo-benzonitrile Formula: C13H6FIN6 MolecularWeight: 392.129813

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1F)C2=NN(N=N2)C3=CC(=CC(=C3)C#N)I

Isomeric SMILES

C1=CC(=NC=C1F)C2=NN(N=N2)C3=CC(=CC(=C3)C#N)I

InChI

InChI=1S/C13H6FIN6/c14-9-1-2-12(17-7-9)13-18-20-21(19-13)11-4-8(6-16)3-10(15)5-11/h1-5,7H