diphenyliodanium; 2,3,4,5,6-pentakis(fluoranyl)benzenesulfonate

Systemtic Name: diphenyliodanium; 2,3,4,5,6-pentakis(fluoranyl)benzenesulfonate Openeye Name: diphenyliodonium; 2,3,4,5,6-pentafluorobenzenesulfonate CAS Name: diphenyliodonium; 2,3,4,5,6-pentafluorobenzenesulfonate IUPAC Name: diphenyliodanium; 2,3,4,5,6-pentafluorobenzenesulfonate Traditional Name: diphenyliodonium; 2,3,4,5,6-pentafluorobesylate Formula: C18H10F5IO3S MolecularWeight: 528.231686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[I+]C2=CC=CC=C2.C1(=C(C(=C(C(=C1F)F)S(=O)(=O)[O-])F)F)F

Isomeric SMILES

C1=CC=C(C=C1)[I+]C2=CC=CC=C2.C1(=C(C(=C(C(=C1F)F)S(=O)(=O)[O-])F)F)F

InChI

InChI=1S/C12H10I.C6HF5O3S/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;7-1-2(8)4(10)6(15(12,13)14)5(11)3(1)9/h1-10H;(H,12,13,14)/q+1;/p-1