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

Systemtic Name: ethyl 7-[2-oxidanylidene-5-(2,6,6-trimethyl-2-oxidanyl-heptyl)sulfanyl-cyclopentyl]heptanoate Openeye Name: ethyl 7-[2-(2-hydroxy-2,6,6-trimethyl-heptyl)sulfanyl-5-oxo-cyclopentyl]heptanoate CAS Name: 7-[2-[(2-hydroxy-2,6,6-trimethylheptyl)thio]-5-oxocyclopentyl]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[2-(2-hydroxy-2,6,6-trimethylheptyl)sulfanyl-5-oxocyclopentyl]heptanoate Traditional Name: 7-[2-[(2-hydroxy-2,6,6-trimethyl-heptyl)thio]-5-keto-cyclopentyl]enanthic acid ethyl ester Formula: C24H44O4S MolecularWeight: 428.66876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCC1C(CCC1=O)SCC(C)(CCCC(C)(C)C)O

Isomeric SMILES

CCOC(=O)CCCCCCC1C(CCC1=O)SCC(C)(CCCC(C)(C)C)O

InChI

InChI=1S/C24H44O4S/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/h19,21,27H,6-18H2,1-5H3