2-chloranyl-5-methoxy-5-oxidanylidene-2-sulfanyl-pentanoic acid

Systemtic Name: 2-chloranyl-5-methoxy-5-oxidanylidene-2-sulfanyl-pentanoic acid Openeye Name: 2-chloro-5-methoxy-5-oxo-2-sulfanyl-pentanoic acid CAS Name: 2-chloro-2-mercapto-5-methoxy-5-oxopentanoic acid IUPAC Name: 2-chloro-5-methoxy-5-oxo-2-sulfanylpentanoic acid Traditional Name: 2-chloro-5-keto-2-mercapto-5-methoxy-valeric acid Formula: C6H9ClO4S MolecularWeight: 212.65126

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(C(=O)O)(S)Cl

Isomeric SMILES

COC(=O)CCC(C(=O)O)(S)Cl

InChI

InChI=1S/C6H9ClO4S/c1-11-4(8)2-3-6(7,12)5(9)10/h12H,2-3H2,1H3,(H,9,10)