[(E,2R,3S)-3-acetyloxy-5-(1,3-dithian-2-yl)-2-oxidanyl-pent-4-enyl] ethanoate

Systemtic Name: [(E,2R,3S)-3-acetyloxy-5-(1,3-dithian-2-yl)-2-oxidanyl-pent-4-enyl] ethanoate Openeye Name: [(E,2R,3S)-3-acetoxy-5-(1,3-dithian-2-yl)-2-hydroxy-pent-4-enyl] acetate CAS Name: acetic acid [(E,2R,3S)-3-acetyloxy-5-(1,3-dithian-2-yl)-2-hydroxypent-4-enyl] ester IUPAC Name: [(E,2R,3S)-3-acetyloxy-5-(1,3-dithian-2-yl)-2-hydroxypent-4-enyl] acetate Traditional Name: acetic acid [(E,2R,3S)-3-acetoxy-5-(1,3-dithian-2-yl)-2-hydroxy-pent-4-enyl] ester Formula: C13H20O5S2 MolecularWeight: 320.4249

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C(C=CC1SCCCS1)OC(=O)C)O

Isomeric SMILES

CC(=O)OC[C@H]([C@H](/C=C/C1SCCCS1)OC(=O)C)O

InChI

InChI=1S/C13H20O5S2/c1-9(14)17-8-11(16)12(18-10(2)15)4-5-13-19-6-3-7-20-13/h4-5,11-13,16H,3,6-8H2,1-2H3/b5-4+/t11-,12+/m1/s1