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3-[ethanoylsulfanyl-(3-hydroxyphenyl)methyl]sulfanylpropanoic acid

3-[ethanoylsulfanyl-(3-hydroxyphenyl)methyl]sulfanylpropanoic acid

Systemtic Name:3-[ethanoylsulfanyl-(3-hydroxyphenyl)methyl]sulfanylpropanoic acid
Openeye Name:3-[acetylsulfanyl-(3-hydroxyphenyl)methyl]sulfanylpropanoic acid
CAS Name:3-[[(acetylthio)-(3-hydroxyphenyl)methyl]thio]propanoic acid
IUPAC Name:3-[acetylsulfanyl-(3-hydroxyphenyl)methyl]sulfanylpropanoic acid
Traditional Name:3-[[(acetylthio)-(3-hydroxyphenyl)methyl]thio]propionic acid
Formula: C12H14O4S2
MolecularWeight: 286.36716
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(C1=CC(=CC=C1)O)SCCC(=O)O


Isomeric SMILES

CC(=O)SC(C1=CC(=CC=C1)O)SCCC(=O)O


InChI

InChI=1S/C12H14O4S2/c1-8(13)18-12(17-6-5-11(15)16)9-3-2-4-10(14)7-9/h2-4,7,12,14H,5-6H2,1H3,(H,15,16)


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