methyl 6-oxidanylidene-3-propylsulfanyl-bicyclo[3.2.0]heptane-4-carboxylate

Systemtic Name: methyl 6-oxidanylidene-3-propylsulfanyl-bicyclo[3.2.0]heptane-4-carboxylate Openeye Name: methyl 6-oxo-3-propylsulfanyl-bicyclo[3.2.0]heptane-4-carboxylate CAS Name: 6-oxo-3-(propylthio)-4-bicyclo[3.2.0]heptanecarboxylic acid methyl ester IUPAC Name: methyl 6-oxo-3-propylsulfanylbicyclo[3.2.0]heptane-4-carboxylate Traditional Name: 6-keto-3-(propylthio)bicyclo[3.2.0]heptane-4-carboxylic acid methyl ester Formula: C12H18O3S MolecularWeight: 242.33452

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1CC2CC(=O)C2C1C(=O)OC

Isomeric SMILES

CCCSC1CC2CC(=O)C2C1C(=O)OC

InChI

InChI=1S/C12H18O3S/c1-3-4-16-9-6-7-5-8(13)10(7)11(9)12(14)15-2/h7,9-11H,3-6H2,1-2H3