S-tert-butyl 2-(3-oxidanylidene-2-pentyl-cyclopentyl)propanethioate

Systemtic Name: S-tert-butyl 2-(3-oxidanylidene-2-pentyl-cyclopentyl)propanethioate Openeye Name: S-tert-butyl 2-(3-oxo-2-pentyl-cyclopentyl)propanethioate CAS Name: 2-(3-oxo-2-pentylcyclopentyl)propanethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl 2-(3-oxo-2-pentylcyclopentyl)propanethioate Traditional Name: 2-(2-amyl-3-keto-cyclopentyl)propanethioic acid S-tert-butyl ester Formula: C17H30O2S MolecularWeight: 298.4839

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(CCC1=O)C(C)C(=O)SC(C)(C)C

Isomeric SMILES

CCCCCC1C(CCC1=O)C(C)C(=O)SC(C)(C)C

InChI

InChI=1S/C17H30O2S/c1-6-7-8-9-14-13(10-11-15(14)18)12(2)16(19)20-17(3,4)5/h12-14H,6-11H2,1-5H3