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

Systemtic Name: 3-chloranyl-2-(2-methyl-3-sulfanyl-propanoyl)oxy-propanoic acid Openeye Name: 3-chloro-2-(2-methyl-3-sulfanyl-propanoyl)oxy-propanoic acid CAS Name: 3-chloro-2-(3-mercapto-2-methyl-1-oxopropoxy)propanoic acid IUPAC Name: 3-chloro-2-(2-methyl-3-sulfanylpropanoyl)oxypropanoic acid Traditional Name: 3-chloro-2-(3-mercapto-2-methyl-propanoyl)oxy-propionic acid Formula: C7H11ClO4S MolecularWeight: 226.67784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H11ClO4S/c1-4(3-13)7(11)12-5(2-8)6(9)10/h4-5,13H,2-3H2,1H3,(H,9,10)