methyl 7-(2-hex-1-ynyl-4-methylsulfanyl-2-oxidanyl-5-oxidanylidene-cyclopent-3-en-1-yl)-7-oxidanyl-heptanoate

Systemtic Name: methyl 7-(2-hex-1-ynyl-4-methylsulfanyl-2-oxidanyl-5-oxidanylidene-cyclopent-3-en-1-yl)-7-oxidanyl-heptanoate Openeye Name: methyl 7-(2-hex-1-ynyl-2-hydroxy-4-methylsulfanyl-5-oxo-cyclopent-3-en-1-yl)-7-hydroxy-heptanoate CAS Name: 7-[2-hex-1-ynyl-2-hydroxy-4-(methylthio)-5-oxo-1-cyclopent-3-enyl]-7-hydroxyheptanoic acid methyl ester IUPAC Name: methyl 7-(2-hex-1-ynyl-2-hydroxy-4-methylsulfanyl-5-oxocyclopent-3-en-1-yl)-7-hydroxyheptanoate Traditional Name: 7-[2-hex-1-ynyl-2-hydroxy-5-keto-4-(methylthio)cyclopent-3-en-1-yl]-7-hydroxy-enanthic acid methyl ester Formula: C20H30O5S MolecularWeight: 382.5142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1(C=C(C(=O)C1C(CCCCCC(=O)OC)O)SC)O

Isomeric SMILES

CCCCC#CC1(C=C(C(=O)C1C(CCCCCC(=O)OC)O)SC)O

InChI

InChI=1S/C20H30O5S/c1-4-5-6-10-13-20(24)14-16(26-3)19(23)18(20)15(21)11-8-7-9-12-17(22)25-2/h14-15,18,21,24H,4-9,11-12H2,1-3H3