ethyl 4-[2-oxidanylidene-5-(3-sulfanylhexyl)cyclopentyl]butanoate

Systemtic Name: ethyl 4-[2-oxidanylidene-5-(3-sulfanylhexyl)cyclopentyl]butanoate Openeye Name: ethyl 4-[2-oxo-5-(3-sulfanylhexyl)cyclopentyl]butanoate CAS Name: 4-[2-(3-mercaptohexyl)-5-oxocyclopentyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[2-oxo-5-(3-sulfanylhexyl)cyclopentyl]butanoate Traditional Name: 4-[2-keto-5-(3-mercaptohexyl)cyclopentyl]butyric acid ethyl ester Formula: C17H30O3S MolecularWeight: 314.4833

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC1CCC(=O)C1CCCC(=O)OCC)S

Isomeric SMILES

CCCC(CCC1CCC(=O)C1CCCC(=O)OCC)S

InChI

InChI=1S/C17H30O3S/c1-3-6-14(21)11-9-13-10-12-16(18)15(13)7-5-8-17(19)20-4-2/h13-15,21H,3-12H2,1-2H3