1-[4-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonylazocane

Systemtic Name: 1-[4-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonylazocane Openeye Name: 1-[4-(tetrazol-1-yl)phenyl]sulfonylazocane CAS Name: 1-[4-(1-tetrazolyl)phenyl]sulfonylazocane IUPAC Name: 1-[4-(tetrazol-1-yl)phenyl]sulfonylazocane Traditional Name: 1-[4-(tetrazol-1-yl)phenyl]sulfonylazocane Formula: C14H19N5O2S MolecularWeight: 321.39796

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)S(=O)(=O)C2=CC=C(C=C2)N3C=NN=N3

Isomeric SMILES

C1CCCN(CCC1)S(=O)(=O)C2=CC=C(C=C2)N3C=NN=N3

InChI

InChI=1S/C14H19N5O2S/c20-22(21,18-10-4-2-1-3-5-11-18)14-8-6-13(7-9-14)19-12-15-16-17-19/h6-9,12H,1-5,10-11H2