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

Systemtic Name: ethyl 7-[2-(6,6-dimethyl-2-oxidanyl-heptyl)sulfanyl-5-oxidanyl-cyclopentyl]heptanoate Openeye Name: ethyl 7-[2-hydroxy-5-(2-hydroxy-6,6-dimethyl-heptyl)sulfanyl-cyclopentyl]heptanoate CAS Name: 7-[2-hydroxy-5-[(2-hydroxy-6,6-dimethylheptyl)thio]cyclopentyl]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[2-hydroxy-5-(2-hydroxy-6,6-dimethylheptyl)sulfanylcyclopentyl]heptanoate Traditional Name: 7-[2-hydroxy-5-[(2-hydroxy-6,6-dimethyl-heptyl)thio]cyclopentyl]enanthic acid ethyl ester Formula: C23H44O4S MolecularWeight: 416.65806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H44O4S/c1-5-27-22(26)13-9-7-6-8-12-19-20(25)14-15-21(19)28-17-18(24)11-10-16-23(2,3)4/h18-21,24-25H,5-17H2,1-4H3