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

Systemtic Name: methyl (7E)-7-(2-hex-1-ynyl-4-methylsulfanyl-2-oxidanyl-5-oxidanylidene-cyclopent-3-en-1-ylidene)heptanoate Openeye Name: methyl (7E)-7-(2-hex-1-ynyl-2-hydroxy-4-methylsulfanyl-5-oxo-cyclopent-3-en-1-ylidene)heptanoate CAS Name: (7E)-7-[2-hex-1-ynyl-2-hydroxy-4-(methylthio)-5-oxo-1-cyclopent-3-enylidene]heptanoic acid methyl ester IUPAC Name: methyl (7E)-7-(2-hex-1-ynyl-2-hydroxy-4-methylsulfanyl-5-oxocyclopent-3-en-1-ylidene)heptanoate Traditional Name: (7E)-7-[2-hex-1-ynyl-2-hydroxy-5-keto-4-(methylthio)cyclopent-3-en-1-ylidene]enanthic acid methyl ester Formula: C20H28O4S MolecularWeight: 364.49892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1(C=C(C(=O)C1=CCCCCCC(=O)OC)SC)O

Isomeric SMILES

CCCCC#CC\1(C=C(C(=O)/C1=C/CCCCCC(=O)OC)SC)O

InChI

InChI=1S/C20H28O4S/c1-4-5-6-11-14-20(23)15-17(25-3)19(22)16(20)12-9-7-8-10-13-18(21)24-2/h12,15,23H,4-10,13H2,1-3H3/b16-12-