3-chloranyl-2-(3-ethanoylsulfanyl-2-methyl-propanoyl)oxy-propanoic acid

Systemtic Name: 3-chloranyl-2-(3-ethanoylsulfanyl-2-methyl-propanoyl)oxy-propanoic acid Openeye Name: 2-(3-acetylsulfanyl-2-methyl-propanoyl)oxy-3-chloro-propanoic acid CAS Name: 2-[3-(acetylthio)-2-methyl-1-oxopropoxy]-3-chloropropanoic acid IUPAC Name: 2-(3-acetylsulfanyl-2-methylpropanoyl)oxy-3-chloropropanoic acid Traditional Name: 2-[3-(acetylthio)-2-methyl-propanoyl]oxy-3-chloro-propionic acid Formula: C9H13ClO5S MolecularWeight: 268.71452

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)OC(CCl)C(=O)O

Isomeric SMILES

CC(CSC(=O)C)C(=O)OC(CCl)C(=O)O

InChI

InChI=1S/C9H13ClO5S/c1-5(4-16-6(2)11)9(14)15-7(3-10)8(12)13/h5,7H,3-4H2,1-2H3,(H,12,13)