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3-ethanoylsulfanylbutanoylphosphonic acid

3-ethanoylsulfanylbutanoylphosphonic acid

Systemtic Name:3-ethanoylsulfanylbutanoylphosphonic acid
Openeye Name:3-acetylsulfanylbutanoylphosphonic acid
CAS Name:[3-(acetylthio)-1-oxobutyl]phosphonic acid
IUPAC Name:3-acetylsulfanylbutanoylphosphonic acid
Traditional Name:3-(acetylthio)butanoylphosphonic acid
Formula: C6H11O5PS
MolecularWeight: 226.187301
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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)P(=O)(O)O)SC(=O)C


Isomeric SMILES

CC(CC(=O)P(=O)(O)O)SC(=O)C


InChI

InChI=1S/C6H11O5PS/c1-4(13-5(2)7)3-6(8)12(9,10)11/h4H,3H2,1-2H3,(H2,9,10,11)


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