ethyl (2S)-2-oxidanyl-4-oxidanylidene-4-phenylsulfanyl-butanoate

Systemtic Name: ethyl (2S)-2-oxidanyl-4-oxidanylidene-4-phenylsulfanyl-butanoate Openeye Name: ethyl (2S)-2-hydroxy-4-oxo-4-phenylsulfanyl-butanoate CAS Name: (2S)-2-hydroxy-4-oxo-4-(phenylthio)butanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-hydroxy-4-oxo-4-phenylsulfanylbutanoate Traditional Name: (2S)-2-hydroxy-4-keto-4-(phenylthio)butyric acid ethyl ester Formula: C12H14O4S MolecularWeight: 254.30216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=O)SC1=CC=CC=C1)O

Isomeric SMILES

CCOC(=O)[C@H](CC(=O)SC1=CC=CC=C1)O

InChI

InChI=1S/C12H14O4S/c1-2-16-12(15)10(13)8-11(14)17-9-6-4-3-5-7-9/h3-7,10,13H,2,8H2,1H3/t10-/m0/s1