methyl 2-(2-methoxy-1-oxidanyl-2-oxidanylidene-ethyl)sulfanyl-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: methyl 2-(2-methoxy-1-oxidanyl-2-oxidanylidene-ethyl)sulfanyl-2-oxidanyl-2-phenyl-ethanoate Openeye Name: methyl 2-hydroxy-2-(1-hydroxy-2-methoxy-2-oxo-ethyl)sulfanyl-2-phenyl-acetate CAS Name: 2-hydroxy-2-[(1-hydroxy-2-methoxy-2-oxoethyl)thio]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-hydroxy-2-(1-hydroxy-2-methoxy-2-oxoethyl)sulfanyl-2-phenylacetate Traditional Name: 2-hydroxy-2-[(1-hydroxy-2-keto-2-methoxy-ethyl)thio]-2-phenyl-acetic acid methyl ester Formula: C12H14O6S MolecularWeight: 286.30096

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(O)SC(C1=CC=CC=C1)(C(=O)OC)O

Isomeric SMILES

COC(=O)C(O)SC(C1=CC=CC=C1)(C(=O)OC)O

InChI

InChI=1S/C12H14O6S/c1-17-9(13)10(14)19-12(16,11(15)18-2)8-6-4-3-5-7-8/h3-7,10,14,16H,1-2H3