1-(2-methyl-1,4-oxathian-4-ium-4-yl)butan-2-one; 1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butane-1-sulfonate

Systemtic Name: 1-(2-methyl-1,4-oxathian-4-ium-4-yl)butan-2-one; 1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butane-1-sulfonate Openeye Name: 1-(2-methyl-1,4-oxathian-4-ium-4-yl)butan-2-one; 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate CAS Name: 1-(2-methyl-1,4-oxathian-4-ium-4-yl)-2-butanone; 1,1,2,2,3,3,4,4,4-nonafluoro-1-butanesulfonate IUPAC Name: 1-(2-methyl-1,4-oxathian-4-ium-4-yl)butan-2-one; 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate Traditional Name: 1-(2-methyl-1,4-oxathian-4-ium-4-yl)butan-2-one; 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate Formula: C13H17F9O5S2 MolecularWeight: 488.386709

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C[S+]1CCOC(C1)C.C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(C(F)(F)F)(F)F

Isomeric SMILES

CCC(=O)C[S+]1CCOC(C1)C.C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(C(F)(F)F)(F)F

InChI

InChI=1S/C9H17O2S.C4HF9O3S/c1-3-9(10)7-12-5-4-11-8(2)6-12;5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h8H,3-7H2,1-2H3;(H,14,15,16)/q+1;/p-1