ethyl 6-[2-oxidanylidene-5-(3-sulfanyloctyl)cyclopentyl]hexanoate

Systemtic Name: ethyl 6-[2-oxidanylidene-5-(3-sulfanyloctyl)cyclopentyl]hexanoate Openeye Name: ethyl 6-[2-oxo-5-(3-sulfanyloctyl)cyclopentyl]hexanoate CAS Name: 6-[2-(3-mercaptooctyl)-5-oxocyclopentyl]hexanoic acid ethyl ester IUPAC Name: ethyl 6-[2-oxo-5-(3-sulfanyloctyl)cyclopentyl]hexanoate Traditional Name: 6-[2-keto-5-(3-mercaptooctyl)cyclopentyl]hexanoic acid ethyl ester Formula: C21H38O3S MolecularWeight: 370.58962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCC1CCC(=O)C1CCCCCC(=O)OCC)S

Isomeric SMILES

CCCCCC(CCC1CCC(=O)C1CCCCCC(=O)OCC)S

InChI

InChI=1S/C21H38O3S/c1-3-5-7-10-18(25)15-13-17-14-16-20(22)19(17)11-8-6-9-12-21(23)24-4-2/h17-19,25H,3-16H2,1-2H3