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

Systemtic Name: cyclohexyl-methyl-(2-oxidanylidenepentyl)sulfanium; 1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butane-1-sulfonate Openeye Name: cyclohexyl-methyl-(2-oxopentyl)sulfonium; 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate CAS Name: cyclohexyl-methyl-(2-oxopentyl)sulfonium; 1,1,2,2,3,3,4,4,4-nonafluoro-1-butanesulfonate IUPAC Name: cyclohexyl-methyl-(2-oxopentyl)sulfanium; 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate Traditional Name: cyclohexyl-(2-ketopentyl)-methyl-sulfonium; 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate Formula: C16H23F9O4S2 MolecularWeight: 514.467049

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCC(=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/C12H23OS.C4HF9O3S/c1-3-7-11(13)10-14(2)12-8-5-4-6-9-12;5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h12H,3-10H2,1-2H3;(H,14,15,16)/q+1;/p-1