(2S,3S)-4-ethoxy-2-(4-methylphenyl)sulfonyloxy-3-oxidanyl-4-oxidanylidene-butanoic acid

Systemtic Name: (2S,3S)-4-ethoxy-2-(4-methylphenyl)sulfonyloxy-3-oxidanyl-4-oxidanylidene-butanoic acid Openeye Name: (2S,3S)-4-ethoxy-3-hydroxy-4-oxo-2-(p-tolylsulfonyloxy)butanoic acid CAS Name: (2S,3S)-4-ethoxy-3-hydroxy-2-(4-methylphenyl)sulfonyloxy-4-oxobutanoic acid IUPAC Name: (2S,3S)-4-ethoxy-3-hydroxy-2-(4-methylphenyl)sulfonyloxy-4-oxobutanoic acid Traditional Name: (2S,3S)-4-ethoxy-3-hydroxy-4-keto-2-tosyloxy-butyric acid Formula: C13H16O8S MolecularWeight: 332.32634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C(=O)O)OS(=O)(=O)C1=CC=C(C=C1)C)O

Isomeric SMILES

CCOC(=O)[C@H]([C@@H](C(=O)O)OS(=O)(=O)C1=CC=C(C=C1)C)O

InChI

InChI=1S/C13H16O8S/c1-3-20-13(17)10(14)11(12(15)16)21-22(18,19)9-6-4-8(2)5-7-9/h4-7,10-11,14H,3H2,1-2H3,(H,15,16)/t10-,11-/m0/s1