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2-[2-(7-oxabicyclo[2.2.1]hept-2-en-5-ylsulfanyl)-2-oxidanylidene-ethyl]hexanoic acid

2-[2-(7-oxabicyclo[2.2.1]hept-2-en-5-ylsulfanyl)-2-oxidanylidene-ethyl]hexanoic acid

Systemtic Name:2-[2-(7-oxabicyclo[2.2.1]hept-2-en-5-ylsulfanyl)-2-oxidanylidene-ethyl]hexanoic acid
Openeye Name:2-[2-(7-oxabicyclo[2.2.1]hept-2-en-5-ylsulfanyl)-2-oxo-ethyl]hexanoic acid
CAS Name:2-[2-(7-oxabicyclo[2.2.1]hept-2-en-5-ylthio)-2-oxoethyl]hexanoic acid
IUPAC Name:2-[2-(7-oxabicyclo[2.2.1]hept-2-en-5-ylsulfanyl)-2-oxoethyl]hexanoic acid
Traditional Name:2-[2-keto-2-(7-oxabicyclo[2.2.1]hept-2-en-5-ylthio)ethyl]hexanoic acid
Formula: C14H20O4S
MolecularWeight: 284.3712
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(=O)SC1CC2C=CC1O2)C(=O)O


Isomeric SMILES

CCCCC(CC(=O)SC1CC2C=CC1O2)C(=O)O


InChI

InChI=1S/C14H20O4S/c1-2-3-4-9(14(16)17)7-13(15)19-12-8-10-5-6-11(12)18-10/h5-6,9-12H,2-4,7-8H2,1H3,(H,16,17)


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