[(2S,3R,4S)-3-acetyloxy-2-tert-butylsulfanyl-1-ethanoyl-3,4-dihydro-2H-pyridin-4-yl] ethanoate

Systemtic Name: [(2S,3R,4S)-3-acetyloxy-2-tert-butylsulfanyl-1-ethanoyl-3,4-dihydro-2H-pyridin-4-yl] ethanoate Openeye Name: [(2S,3R,4S)-3-acetoxy-1-acetyl-2-tert-butylsulfanyl-3,4-dihydro-2H-pyridin-4-yl] acetate CAS Name: acetic acid [(2S,3R,4S)-1-acetyl-3-acetyloxy-2-(tert-butylthio)-3,4-dihydro-2H-pyridin-4-yl] ester IUPAC Name: [(2S,3R,4S)-1-acetyl-3-acetyloxy-2-tert-butylsulfanyl-3,4-dihydro-2H-pyridin-4-yl] acetate Traditional Name: acetic acid [(2S,3R,4S)-3-acetoxy-1-acetyl-2-(tert-butylthio)-3,4-dihydro-2H-pyridin-4-yl] ester Formula: C15H23NO5S MolecularWeight: 329.41182

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC(C(C1SC(C)(C)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)N1C=C[C@@H]([C@H]([C@@H]1SC(C)(C)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C15H23NO5S/c1-9(17)16-8-7-12(20-10(2)18)13(21-11(3)19)14(16)22-15(4,5)6/h7-8,12-14H,1-6H3/t12-,13+,14-/m0/s1