[(2R,3S,4R)-4-(1,3-dithian-2-yl)-4-ethanoyl-3-methyl-5-oxidanylidene-oxolan-2-yl] ethanoate

Systemtic Name: [(2R,3S,4R)-4-(1,3-dithian-2-yl)-4-ethanoyl-3-methyl-5-oxidanylidene-oxolan-2-yl] ethanoate Openeye Name: [(2R,3S,4R)-4-acetyl-4-(1,3-dithian-2-yl)-3-methyl-5-oxo-tetrahydrofuran-2-yl] acetate CAS Name: acetic acid [(2R,3S,4R)-4-acetyl-4-(1,3-dithian-2-yl)-3-methyl-5-oxo-2-oxolanyl] ester IUPAC Name: [(2R,3S,4R)-4-acetyl-4-(1,3-dithian-2-yl)-3-methyl-5-oxooxolan-2-yl] acetate Traditional Name: acetic acid [(2R,3S,4R)-4-acetyl-4-(1,3-dithian-2-yl)-5-keto-3-methyl-tetrahydrofuran-2-yl] ester Formula: C13H18O5S2 MolecularWeight: 318.40902

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC(=O)C1(C2SCCCS2)C(=O)C)OC(=O)C

Isomeric SMILES

C[C@@H]1[C@@H](OC(=O)[C@]1(C2SCCCS2)C(=O)C)OC(=O)C

InChI

InChI=1S/C13H18O5S2/c1-7-10(17-9(3)15)18-11(16)13(7,8(2)14)12-19-5-4-6-20-12/h7,10,12H,4-6H2,1-3H3/t7-,10-,13-/m1/s1