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5-(4-methylsulfanylphenoxy)-3-oxidanyl-pentanoic acid

5-(4-methylsulfanylphenoxy)-3-oxidanyl-pentanoic acid

Systemtic Name:5-(4-methylsulfanylphenoxy)-3-oxidanyl-pentanoic acid
Openeye Name:3-hydroxy-5-(4-methylsulfanylphenoxy)pentanoic acid
CAS Name:3-hydroxy-5-[4-(methylthio)phenoxy]pentanoic acid
IUPAC Name:3-hydroxy-5-(4-methylsulfanylphenoxy)pentanoic acid
Traditional Name:3-hydroxy-5-[4-(methylthio)phenoxy]valeric acid
Formula: C12H16O4S
MolecularWeight: 256.31804
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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)OCCC(CC(=O)O)O


Isomeric SMILES

CSC1=CC=C(C=C1)OCCC(CC(=O)O)O


InChI

InChI=1S/C12H16O4S/c1-17-11-4-2-10(3-5-11)16-7-6-9(13)8-12(14)15/h2-5,9,13H,6-8H2,1H3,(H,14,15)


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