ethyl 7-[2-oxidanyl-5-(2,6,6-trimethyl-2-oxidanyl-heptyl)sulfanyl-cyclopentyl]heptanoate

Systemtic Name: ethyl 7-[2-oxidanyl-5-(2,6,6-trimethyl-2-oxidanyl-heptyl)sulfanyl-cyclopentyl]heptanoate Openeye Name: ethyl 7-[2-hydroxy-5-(2-hydroxy-2,6,6-trimethyl-heptyl)sulfanyl-cyclopentyl]heptanoate CAS Name: 7-[2-hydroxy-5-[(2-hydroxy-2,6,6-trimethylheptyl)thio]cyclopentyl]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[2-hydroxy-5-(2-hydroxy-2,6,6-trimethylheptyl)sulfanylcyclopentyl]heptanoate Traditional Name: 7-[2-hydroxy-5-[(2-hydroxy-2,6,6-trimethyl-heptyl)thio]cyclopentyl]enanthic acid ethyl ester Formula: C24H46O4S MolecularWeight: 430.68464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCC1C(CCC1SCC(C)(CCCC(C)(C)C)O)O

Isomeric SMILES

CCOC(=O)CCCCCCC1C(CCC1SCC(C)(CCCC(C)(C)C)O)O

InChI

InChI=1S/C24H46O4S/c1-6-28-22(26)13-10-8-7-9-12-19-20(25)14-15-21(19)29-18-24(5,27)17-11-16-23(2,3)4/h19-21,25,27H,6-18H2,1-5H3