cyclohexyl-methyl-(2-oxidanylidenepropyl)sulfanium; 1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butane-1-sulfonate

Systemtic Name: cyclohexyl-methyl-(2-oxidanylidenepropyl)sulfanium; 1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butane-1-sulfonate Openeye Name: acetonyl-cyclohexyl-methyl-sulfonium; 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate CAS Name: cyclohexyl-methyl-(2-oxopropyl)sulfonium; 1,1,2,2,3,3,4,4,4-nonafluoro-1-butanesulfonate IUPAC Name: cyclohexyl-methyl-(2-oxopropyl)sulfanium; 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate Traditional Name: acetonyl-cyclohexyl-methyl-sulfonium; 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate Formula: C14H19F9O4S2 MolecularWeight: 486.413889

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C[S+](C)C1CCCCC1.C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(C(F)(F)F)(F)F

Isomeric SMILES

CC(=O)C[S+](C)C1CCCCC1.C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(C(F)(F)F)(F)F

InChI

InChI=1S/C10H19OS.C4HF9O3S/c1-9(11)8-12(2)10-6-4-3-5-7-10;5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h10H,3-8H2,1-2H3;(H,14,15,16)/q+1;/p-1