diphenyliodanium; 4,7,7-trimethyl-3-oxidanylidene-bicyclo[2.2.1]heptane-2-sulfonate

Systemtic Name: diphenyliodanium; 4,7,7-trimethyl-3-oxidanylidene-bicyclo[2.2.1]heptane-2-sulfonate Openeye Name: diphenyliodonium; 4,7,7-trimethyl-3-oxo-norbornane-2-sulfonate CAS Name: diphenyliodonium; 4,7,7-trimethyl-3-oxo-2-bicyclo[2.2.1]heptanesulfonate IUPAC Name: diphenyliodanium; 4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-2-sulfonate Traditional Name: diphenyliodonium; 3-keto-4,7,7-trimethyl-norbornane-2-sulfonate Formula: C22H25IO4S MolecularWeight: 512.40097

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1(C(=O)C2S(=O)(=O)[O-])C)C.C1=CC=C(C=C1)[I+]C2=CC=CC=C2

Isomeric SMILES

CC1(C2CCC1(C(=O)C2S(=O)(=O)[O-])C)C.C1=CC=C(C=C1)[I+]C2=CC=CC=C2

InChI

InChI=1S/C12H10I.C10H16O4S/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-9(2)6-4-5-10(9,3)8(11)7(6)15(12,13)14/h1-10H;6-7H,4-5H2,1-3H3,(H,12,13,14)/q+1;/p-1