ethyl (1S,6S)-6-[(2S)-2-ethylsulfanylpropyl]-2-oxidanyl-4-oxidanylidene-cyclohex-2-ene-1-carboxylate

Systemtic Name: ethyl (1S,6S)-6-[(2S)-2-ethylsulfanylpropyl]-2-oxidanyl-4-oxidanylidene-cyclohex-2-ene-1-carboxylate Openeye Name: ethyl (1S,6S)-6-[(2S)-2-ethylsulfanylpropyl]-2-hydroxy-4-oxo-cyclohex-2-ene-1-carboxylate CAS Name: (1S,6S)-6-[(2S)-2-(ethylthio)propyl]-2-hydroxy-4-oxo-1-cyclohex-2-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,6S)-6-[(2S)-2-ethylsulfanylpropyl]-2-hydroxy-4-oxocyclohex-2-ene-1-carboxylate Traditional Name: (1S,6S)-6-[(2S)-2-(ethylthio)propyl]-2-hydroxy-4-keto-cyclohex-2-ene-1-carboxylic acid ethyl ester Formula: C14H22O4S MolecularWeight: 286.38708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC(=O)C=C1O)CC(C)SCC

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H](CC(=O)C=C1O)C[C@H](C)SCC

InChI

InChI=1S/C14H22O4S/c1-4-18-14(17)13-10(6-9(3)19-5-2)7-11(15)8-12(13)16/h8-10,13,16H,4-7H2,1-3H3/t9-,10+,13-/m0/s1