6-(2-acetyloxyphenyl)sulfanylhexanoic acid

Systemtic Name: 6-(2-acetyloxyphenyl)sulfanylhexanoic acid Openeye Name: 6-(2-acetoxyphenyl)sulfanylhexanoic acid CAS Name: 6-[(2-acetyloxyphenyl)thio]hexanoic acid IUPAC Name: 6-(2-acetyloxyphenyl)sulfanylhexanoic acid Traditional Name: 6-[(2-acetoxyphenyl)thio]hexanoic acid Formula: C14H18O4S MolecularWeight: 282.35532

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1SCCCCCC(=O)O

Isomeric SMILES

CC(=O)OC1=CC=CC=C1SCCCCCC(=O)O

InChI

InChI=1S/C14H18O4S/c1-11(15)18-12-7-4-5-8-13(12)19-10-6-2-3-9-14(16)17/h4-5,7-8H,2-3,6,9-10H2,1H3,(H,16,17)