ethane; ethyl (3R)-3-[(1R,2R)-2-ethyl-1-oxidanylidene-1,3-dithian-2-yl]-3-oxidanyl-pentanoate

Systemtic Name: ethane; ethyl (3R)-3-[(1R,2R)-2-ethyl-1-oxidanylidene-1,3-dithian-2-yl]-3-oxidanyl-pentanoate Openeye Name: ethane; ethyl (3R)-3-[(1R,2R)-2-ethyl-1-oxo-1,3-dithian-2-yl]-3-hydroxy-pentanoate CAS Name: ethane; (3R)-3-[(1R,2R)-2-ethyl-1-oxo-1,3-dithian-2-yl]-3-hydroxypentanoic acid ethyl ester IUPAC Name: ethane; ethyl (3R)-3-[(1R,2R)-2-ethyl-1-oxo-1,3-dithian-2-yl]-3-hydroxypentanoate Traditional Name: ethane; (3R)-3-[(1R,2R)-2-ethyl-1-keto-1,3-dithian-2-yl]-3-hydroxy-valeric acid ethyl ester Formula: C15H30O4S2 MolecularWeight: 338.5263

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Descriptors Computed from Structure

Canonical SMILES:

CC.CCC1(SCCCS1=O)C(CC)(CC(=O)OCC)O

Isomeric SMILES

CC.CC[C@]1(SCCC[S@]1=O)[C@@](CC)(CC(=O)OCC)O

InChI

InChI=1S/C13H24O4S2.C2H6/c1-4-12(15,10-11(14)17-6-3)13(5-2)18-8-7-9-19(13)16;1-2/h15H,4-10H2,1-3H3;1-2H3/t12-,13-,19-;/m1./s1