ethyl 8-[2-oxidanylidene-5-(3-sulfanyloctyl)cyclopentyl]octanoate

Systemtic Name: ethyl 8-[2-oxidanylidene-5-(3-sulfanyloctyl)cyclopentyl]octanoate Openeye Name: ethyl 8-[2-oxo-5-(3-sulfanyloctyl)cyclopentyl]octanoate CAS Name: 8-[2-(3-mercaptooctyl)-5-oxocyclopentyl]octanoic acid ethyl ester IUPAC Name: ethyl 8-[2-oxo-5-(3-sulfanyloctyl)cyclopentyl]octanoate Traditional Name: 8-[2-keto-5-(3-mercaptooctyl)cyclopentyl]caprylic acid ethyl ester Formula: C23H42O3S MolecularWeight: 398.64278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCC1CCC(=O)C1CCCCCCCC(=O)OCC)S

Isomeric SMILES

CCCCCC(CCC1CCC(=O)C1CCCCCCCC(=O)OCC)S

InChI

InChI=1S/C23H42O3S/c1-3-5-9-12-20(27)17-15-19-16-18-22(24)21(19)13-10-7-6-8-11-14-23(25)26-4-2/h19-21,27H,3-18H2,1-2H3