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2-ethanoyl-3-sulfanyl-octanoic acid

2-ethanoyl-3-sulfanyl-octanoic acid

Systemtic Name:2-ethanoyl-3-sulfanyl-octanoic acid
Openeye Name:2-acetyl-3-sulfanyl-octanoic acid
CAS Name:2-acetyl-3-mercaptooctanoic acid
IUPAC Name:2-acetyl-3-sulfanyloctanoic acid
Traditional Name:2-acetyl-3-mercapto-caprylic acid
Formula: C10H18O3S
MolecularWeight: 218.31312
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(C(=O)C)C(=O)O)S


Isomeric SMILES

CCCCCC(C(C(=O)C)C(=O)O)S


InChI

InChI=1S/C10H18O3S/c1-3-4-5-6-8(14)9(7(2)11)10(12)13/h8-9,14H,3-6H2,1-2H3,(H,12,13)


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