tert-butyl-(2-cyclopentyl-2-oxidanylidene-ethyl)-methyl-sulfanium; 1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butane-1-sulfonate

Systemtic Name: tert-butyl-(2-cyclopentyl-2-oxidanylidene-ethyl)-methyl-sulfanium; 1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butane-1-sulfonate Openeye Name: tert-butyl-(2-cyclopentyl-2-oxo-ethyl)-methyl-sulfonium; 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate CAS Name: tert-butyl-(2-cyclopentyl-2-oxoethyl)-methylsulfonium; 1,1,2,2,3,3,4,4,4-nonafluoro-1-butanesulfonate IUPAC Name: tert-butyl-(2-cyclopentyl-2-oxoethyl)-methylsulfanium; 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate Traditional Name: tert-butyl-(2-cyclopentyl-2-keto-ethyl)-methyl-sulfonium; 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate Formula: C16H23F9O4S2 MolecularWeight: 514.467049

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[S+](C)CC(=O)C1CCCC1.C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(C(F)(F)F)(F)F

Isomeric SMILES

CC(C)(C)[S+](C)CC(=O)C1CCCC1.C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(C(F)(F)F)(F)F

InChI

InChI=1S/C12H23OS.C4HF9O3S/c1-12(2,3)14(4)9-11(13)10-7-5-6-8-10;5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h10H,5-9H2,1-4H3;(H,14,15,16)/q+1;/p-1