5-ethylsulfanyl-5-methoxycarbonyl-2-methyl-3-oxidanylidene-cyclopentene-1-carboxylic acid

Systemtic Name: 5-ethylsulfanyl-5-methoxycarbonyl-2-methyl-3-oxidanylidene-cyclopentene-1-carboxylic acid Openeye Name: 5-ethylsulfanyl-5-methoxycarbonyl-2-methyl-3-oxo-cyclopentene-1-carboxylic acid CAS Name: 5-(ethylthio)-5-methoxycarbonyl-2-methyl-3-oxo-1-cyclopentenecarboxylic acid IUPAC Name: 5-ethylsulfanyl-5-methoxycarbonyl-2-methyl-3-oxocyclopentene-1-carboxylic acid Traditional Name: 5-carbomethoxy-5-(ethylthio)-3-keto-2-methyl-cyclopentene-1-carboxylic acid Formula: C11H14O5S MolecularWeight: 258.29086

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1(CC(=O)C(=C1C(=O)O)C)C(=O)OC

Isomeric SMILES

CCSC1(CC(=O)C(=C1C(=O)O)C)C(=O)OC

InChI

InChI=1S/C11H14O5S/c1-4-17-11(10(15)16-3)5-7(12)6(2)8(11)9(13)14/h4-5H2,1-3H3,(H,13,14)