[(2R,3S,4R)-4,5-diacetyloxy-2-(isothiocyanatomethyl)oxolan-3-yl] ethanoate

Systemtic Name: [(2R,3S,4R)-4,5-diacetyloxy-2-(isothiocyanatomethyl)oxolan-3-yl] ethanoate Openeye Name: [(2R,3S,4R)-4,5-diacetoxy-2-(isothiocyanatomethyl)tetrahydrofuran-3-yl] acetate CAS Name: acetic acid [(2R,3S,4R)-4,5-diacetyloxy-2-(isothiocyanatomethyl)-3-oxolanyl] ester IUPAC Name: [(2R,3S,4R)-4,5-diacetyloxy-2-(isothiocyanatomethyl)oxolan-3-yl] acetate Traditional Name: acetic acid [(2R,3S,4R)-4,5-diacetoxy-2-(isothiocyanatomethyl)tetrahydrofuran-3-yl] ester Formula: C12H15NO7S MolecularWeight: 317.315

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(OC(C1OC(=O)C)OC(=O)C)CN=C=S

Isomeric SMILES

CC(=O)O[C@H]1[C@H](OC([C@@H]1OC(=O)C)OC(=O)C)CN=C=S

InChI

InChI=1S/C12H15NO7S/c1-6(14)17-10-9(4-13-5-21)20-12(19-8(3)16)11(10)18-7(2)15/h9-12H,4H2,1-3H3/t9-,10+,11-,12?/m1/s1