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2-ethylsulfanyl-6-(2-oxidanylpropyl)benzoic acid

2-ethylsulfanyl-6-(2-oxidanylpropyl)benzoic acid

Systemtic Name:2-ethylsulfanyl-6-(2-oxidanylpropyl)benzoic acid
Openeye Name:2-ethylsulfanyl-6-(2-hydroxypropyl)benzoic acid
CAS Name:2-(ethylthio)-6-(2-hydroxypropyl)benzoic acid
IUPAC Name:2-ethylsulfanyl-6-(2-hydroxypropyl)benzoic acid
Traditional Name:2-(ethylthio)-6-(2-hydroxypropyl)benzoic acid
Formula: C12H16O3S
MolecularWeight: 240.31864
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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC(=C1C(=O)O)CC(C)O


Isomeric SMILES

CCSC1=CC=CC(=C1C(=O)O)CC(C)O


InChI

InChI=1S/C12H16O3S/c1-3-16-10-6-4-5-9(7-8(2)13)11(10)12(14)15/h4-6,8,13H,3,7H2,1-2H3,(H,14,15)


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