ethyl 7-[2-(2,3-dimethylheptylsulfanyl)-2-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoate

Systemtic Name: ethyl 7-[2-(2,3-dimethylheptylsulfanyl)-2-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoate Openeye Name: ethyl 7-[2-(2,3-dimethylheptylsulfanyl)-2-hydroxy-5-oxo-cyclopentyl]heptanoate CAS Name: 7-[2-(2,3-dimethylheptylthio)-2-hydroxy-5-oxocyclopentyl]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[2-(2,3-dimethylheptylsulfanyl)-2-hydroxy-5-oxocyclopentyl]heptanoate Traditional Name: 7-[2-(2,3-dimethylheptylthio)-2-hydroxy-5-keto-cyclopentyl]enanthic acid ethyl ester Formula: C23H42O4S MolecularWeight: 414.64218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C(C)CSC1(CCC(=O)C1CCCCCCC(=O)OCC)O

Isomeric SMILES

CCCCC(C)C(C)CSC1(CCC(=O)C1CCCCCCC(=O)OCC)O

InChI

InChI=1S/C23H42O4S/c1-5-7-12-18(3)19(4)17-28-23(26)16-15-21(24)20(23)13-10-8-9-11-14-22(25)27-6-2/h18-20,26H,5-17H2,1-4H3