ethyl 7-[2-oxidanylidene-5-(3-sulfanylhexyl)cyclopentyl]heptanoate

Systemtic Name: ethyl 7-[2-oxidanylidene-5-(3-sulfanylhexyl)cyclopentyl]heptanoate Openeye Name: ethyl 7-[2-oxo-5-(3-sulfanylhexyl)cyclopentyl]heptanoate CAS Name: 7-[2-(3-mercaptohexyl)-5-oxocyclopentyl]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[2-oxo-5-(3-sulfanylhexyl)cyclopentyl]heptanoate Traditional Name: 7-[2-keto-5-(3-mercaptohexyl)cyclopentyl]enanthic acid ethyl ester Formula: C20H36O3S MolecularWeight: 356.56304

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC1CCC(=O)C1CCCCCCC(=O)OCC)S

Isomeric SMILES

CCCC(CCC1CCC(=O)C1CCCCCCC(=O)OCC)S

InChI

InChI=1S/C20H36O3S/c1-3-9-17(24)14-12-16-13-15-19(21)18(16)10-7-5-6-8-11-20(22)23-4-2/h16-18,24H,3-15H2,1-2H3