2-(ethanoylsulfanylmethyl)-4-methoxy-4-oxidanylidene-butanoic acid

Systemtic Name: 2-(ethanoylsulfanylmethyl)-4-methoxy-4-oxidanylidene-butanoic acid Openeye Name: 2-(acetylsulfanylmethyl)-4-methoxy-4-oxo-butanoic acid CAS Name: 2-[(acetylthio)methyl]-4-methoxy-4-oxobutanoic acid IUPAC Name: 2-(acetylsulfanylmethyl)-4-methoxy-4-oxobutanoic acid Traditional Name: 2-[(acetylthio)methyl]-4-keto-4-methoxy-butyric acid Formula: C8H12O5S MolecularWeight: 220.24288

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(CC(=O)OC)C(=O)O

Isomeric SMILES

CC(=O)SCC(CC(=O)OC)C(=O)O

InChI

InChI=1S/C8H12O5S/c1-5(9)14-4-6(8(11)12)3-7(10)13-2/h6H,3-4H2,1-2H3,(H,11,12)