dimethyl-(1-oxidanyl-1-oxidanylidene-hexan-2-yl)sulfanium bromide

Systemtic Name: dimethyl-(1-oxidanyl-1-oxidanylidene-hexan-2-yl)sulfanium bromide Openeye Name: 1-carboxypentyl(dimethyl)sulfonium bromide CAS Name: (1-hydroxy-1-oxohexan-2-yl)-dimethylsulfonium bromide IUPAC Name: (1-hydroxy-1-oxohexan-2-yl)-dimethylsulfanium bromide Traditional Name: 1-carboxypentyl(dimethyl)sulfonium bromide Formula: C8H17BrO2S MolecularWeight: 257.18838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)[S+](C)C.[Br-]

Isomeric SMILES

CCCCC(C(=O)O)[S+](C)C.[Br-]

InChI

InChI=1S/C8H16O2S.BrH/c1-4-5-6-7(8(9)10)11(2)3;/h7H,4-6H2,1-3H3;1H