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2-octan-3-ylsulfanyl-2-oxidanyl-ethanoate

2-octan-3-ylsulfanyl-2-oxidanyl-ethanoate

Systemtic Name:2-octan-3-ylsulfanyl-2-oxidanyl-ethanoate
Openeye Name:2-(1-ethylhexylsulfanyl)-2-hydroxy-acetate
CAS Name:2-hydroxy-2-(octan-3-ylthio)acetate
IUPAC Name:2-hydroxy-2-octan-3-ylsulfanylacetate
Traditional Name:2-(1-ethylhexylthio)-2-hydroxy-acetate
Formula: C10H19O3S-
MolecularWeight: 219.32106
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)SC(C(=O)[O-])O


Isomeric SMILES

CCCCCC(CC)SC(C(=O)[O-])O


InChI

InChI=1S/C10H20O3S/c1-3-5-6-7-8(4-2)14-10(13)9(11)12/h8,10,13H,3-7H2,1-2H3,(H,11,12)/p-1


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