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2-(4-methoxyphenyl)sulfanylhexanoic acid

2-(4-methoxyphenyl)sulfanylhexanoic acid

Systemtic Name:2-(4-methoxyphenyl)sulfanylhexanoic acid
Openeye Name:2-(4-methoxyphenyl)sulfanylhexanoic acid
CAS Name:2-[(4-methoxyphenyl)thio]hexanoic acid
IUPAC Name:2-(4-methoxyphenyl)sulfanylhexanoic acid
Traditional Name:2-[(4-methoxyphenyl)thio]hexanoic acid
Formula: C13H18O3S
MolecularWeight: 254.34522
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)SC1=CC=C(C=C1)OC


Isomeric SMILES

CCCCC(C(=O)O)SC1=CC=C(C=C1)OC


InChI

InChI=1S/C13H18O3S/c1-3-4-5-12(13(14)15)17-11-8-6-10(16-2)7-9-11/h6-9,12H,3-5H2,1-2H3,(H,14,15)


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