cyclohexyl-methyl-(2-oxidanylidenepentyl)sulfanium; tris(fluoranyl)methanesulfonate

Systemtic Name: cyclohexyl-methyl-(2-oxidanylidenepentyl)sulfanium; tris(fluoranyl)methanesulfonate Openeye Name: cyclohexyl-methyl-(2-oxopentyl)sulfonium; trifluoromethanesulfonate CAS Name: cyclohexyl-methyl-(2-oxopentyl)sulfonium; trifluoromethanesulfonate IUPAC Name: cyclohexyl-methyl-(2-oxopentyl)sulfanium; trifluoromethanesulfonate Traditional Name: cyclohexyl-(2-ketopentyl)-methyl-sulfonium triflate Formula: C13H23F3O4S2 MolecularWeight: 364.44453

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H23OS.CHF3O3S/c1-3-7-11(13)10-14(2)12-8-5-4-6-9-12;2-1(3,4)8(5,6)7/h12H,3-10H2,1-2H3;(H,5,6,7)/q+1;/p-1