methyl 3-[(3-ethanoyl-5-fluoranyl-2-oxidanyl-phenyl)methylsulfanyl]propanoate

Systemtic Name: methyl 3-[(3-ethanoyl-5-fluoranyl-2-oxidanyl-phenyl)methylsulfanyl]propanoate Openeye Name: methyl 3-[(3-acetyl-5-fluoro-2-hydroxy-phenyl)methylsulfanyl]propanoate CAS Name: 3-[(3-acetyl-5-fluoro-2-hydroxyphenyl)methylthio]propanoic acid methyl ester IUPAC Name: methyl 3-[(3-acetyl-5-fluoro-2-hydroxyphenyl)methylsulfanyl]propanoate Traditional Name: 3-[(3-acetyl-5-fluoro-2-hydroxy-benzyl)thio]propionic acid methyl ester Formula: C13H15FO4S MolecularWeight: 286.319203

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC(=C1O)CSCCC(=O)OC)F

Isomeric SMILES

CC(=O)C1=CC(=CC(=C1O)CSCCC(=O)OC)F

InChI

InChI=1S/C13H15FO4S/c1-8(15)11-6-10(14)5-9(13(11)17)7-19-4-3-12(16)18-2/h5-6,17H,3-4,7H2,1-2H3