potassium 2-hexanoylsulfanyl-2-oxidanyl-ethanoate

Systemtic Name: potassium 2-hexanoylsulfanyl-2-oxidanyl-ethanoate Openeye Name: potassium 2-hexanoylsulfanyl-2-hydroxy-acetate CAS Name: potassium 2-hydroxy-2-(1-oxohexylthio)acetate IUPAC Name: potassium 2-hexanoylsulfanyl-2-hydroxyacetate Traditional Name: potassium 2-(caproylthio)-2-hydroxy-acetate Formula: C8H13KO4S MolecularWeight: 244.34972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)SC(C(=O)[O-])O.[K+]

Isomeric SMILES

CCCCCC(=O)SC(C(=O)[O-])O.[K+]

InChI

InChI=1S/C8H14O4S.K/c1-2-3-4-5-6(9)13-8(12)7(10)11;/h8,12H,2-5H2,1H3,(H,10,11);/q;+1/p-1