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

Systemtic Name: 4-[2-(3-iodanylprop-2-ynyl)-1,2,3,4-tetrazol-5-yl]benzenecarbonitrile Openeye Name: 4-[2-(3-iodoprop-2-ynyl)tetrazol-5-yl]benzonitrile CAS Name: 4-[2-(3-iodoprop-2-ynyl)-5-tetrazolyl]benzonitrile IUPAC Name: 4-[2-(3-iodoprop-2-ynyl)tetrazol-5-yl]benzonitrile Traditional Name: 4-[2-(3-iodoprop-2-ynyl)tetrazol-5-yl]benzonitrile Formula: C11H6IN5 MolecularWeight: 335.10331

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C2=NN(N=N2)CC#CI

Isomeric SMILES

C1=CC(=CC=C1C#N)C2=NN(N=N2)CC#CI

InChI

InChI=1S/C11H6IN5/c12-6-1-7-17-15-11(14-16-17)10-4-2-9(8-13)3-5-10/h2-5H,7H2