3-[4-ethanoylsulfanyl-4-methyl-2-(3-oxidanidyl-3-oxidanylidene-propyl)-1,3-oxathiolan-2-yl]propanoate

Systemtic Name: 3-[4-ethanoylsulfanyl-4-methyl-2-(3-oxidanidyl-3-oxidanylidene-propyl)-1,3-oxathiolan-2-yl]propanoate Openeye Name: 3-[4-acetylsulfanyl-4-methyl-2-(3-oxido-3-oxo-propyl)-1,3-oxathiolan-2-yl]propanoate CAS Name: 3-[4-(acetylthio)-4-methyl-2-(3-oxido-3-oxopropyl)-1,3-oxathiolan-2-yl]propanoate IUPAC Name: 3-[4-acetylsulfanyl-4-methyl-2-(3-oxido-3-oxopropyl)-1,3-oxathiolan-2-yl]propanoate Traditional Name: 3-[4-(acetylthio)-2-(3-keto-3-oxido-propyl)-4-methyl-1,3-oxathiolan-2-yl]propionate Formula: C12H16O6S2-2 MolecularWeight: 320.38184

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1(COC(S1)(CCC(=O)[O-])CCC(=O)[O-])C

Isomeric SMILES

CC(=O)SC1(COC(S1)(CCC(=O)[O-])CCC(=O)[O-])C

InChI

InChI=1S/C12H18O6S2/c1-8(13)19-11(2)7-18-12(20-11,5-3-9(14)15)6-4-10(16)17/h3-7H2,1-2H3,(H,14,15)(H,16,17)/p-2