2-ethanoylsulfanyl-4-methoxy-4-oxidanylidene-butanoic acid

Systemtic Name: 2-ethanoylsulfanyl-4-methoxy-4-oxidanylidene-butanoic acid Openeye Name: 2-acetylsulfanyl-4-methoxy-4-oxo-butanoic acid CAS Name: 2-(acetylthio)-4-methoxy-4-oxobutanoic acid IUPAC Name: 2-acetylsulfanyl-4-methoxy-4-oxobutanoic acid Traditional Name: 2-(acetylthio)-4-keto-4-methoxy-butyric acid Formula: C7H10O5S MolecularWeight: 206.2163

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CC(=O)OC)C(=O)O

Isomeric SMILES

CC(=O)SC(CC(=O)OC)C(=O)O

InChI

InChI=1S/C7H10O5S/c1-4(8)13-5(7(10)11)3-6(9)12-2/h5H,3H2,1-2H3,(H,10,11)