methyl 2-(6-ethylsulfanyl-3-oxidanylidene-2-oxabicyclo[3.3.1]nonan-7-yl)ethanoate

Systemtic Name: methyl 2-(6-ethylsulfanyl-3-oxidanylidene-2-oxabicyclo[3.3.1]nonan-7-yl)ethanoate Openeye Name: methyl 2-(6-ethylsulfanyl-3-oxo-2-oxabicyclo[3.3.1]nonan-7-yl)acetate CAS Name: 2-[6-(ethylthio)-3-oxo-2-oxabicyclo[3.3.1]nonan-7-yl]acetic acid methyl ester IUPAC Name: methyl 2-(6-ethylsulfanyl-3-oxo-2-oxabicyclo[3.3.1]nonan-7-yl)acetate Traditional Name: 2-[6-(ethylthio)-3-keto-2-oxabicyclo[3.3.1]nonan-7-yl]acetic acid methyl ester Formula: C13H20O4S MolecularWeight: 272.3605

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1C2CC(CC1CC(=O)OC)OC(=O)C2

Isomeric SMILES

CCSC1C2CC(CC1CC(=O)OC)OC(=O)C2

InChI

InChI=1S/C13H20O4S/c1-3-18-13-8(6-11(14)16-2)4-10-5-9(13)7-12(15)17-10/h8-10,13H,3-7H2,1-2H3