hexadecyl(dimethyl)sulfanium; methyl sulfate

Systemtic Name: hexadecyl(dimethyl)sulfanium; methyl sulfate Openeye Name: hexadecyl(dimethyl)sulfonium; methyl sulfate CAS Name: hexadecyl(dimethyl)sulfonium; methyl sulfate IUPAC Name: hexadecyl(dimethyl)sulfanium; methyl sulfate Traditional Name: cetyl(dimethyl)sulfonium; methyl sulfate Formula: C19H42O4S2 MolecularWeight: 398.66438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[S+](C)C.COS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[S+](C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C18H39S.CH4O4S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(2)3;1-5-6(2,3)4/h4-18H2,1-3H3;1H3,(H,2,3,4)/q+1;/p-1