iodanium (5-methyl-2-propan-2-yl-cyclohexyl) tris(fluoranyl)methanesulfonate

Systemtic Name: iodanium (5-methyl-2-propan-2-yl-cyclohexyl) tris(fluoranyl)methanesulfonate Openeye Name: iodonium (2-isopropyl-5-methyl-cyclohexyl) trifluoromethanesulfonate CAS Name: iodonium trifluoromethanesulfonic acid (5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: iodanium (5-methyl-2-propan-2-ylcyclohexyl) trifluoromethanesulfonate Traditional Name: iodonium trifluoromethanesulfonic acid (2-isopropyl-5-methyl-cyclohexyl) ester Formula: C11H21F3IO3S+ MolecularWeight: 417.24732

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OS(=O)(=O)C(F)(F)F)C(C)C.[IH2+]

Isomeric SMILES

CC1CCC(C(C1)OS(=O)(=O)C(F)(F)F)C(C)C.[IH2+]

InChI

InChI=1S/C11H19F3O3S.H2I/c1-7(2)9-5-4-8(3)6-10(9)17-18(15,16)11(12,13)14;/h7-10H,4-6H2,1-3H3;1H2/q;+1