[(3R,4R,5S,6S)-4,5-diacetyloxy-6-bromanyl-6-cyano-oxan-3-yl] ethanoate

Systemtic Name: [(3R,4R,5S,6S)-4,5-diacetyloxy-6-bromanyl-6-cyano-oxan-3-yl] ethanoate Openeye Name: [(3R,4R,5S,6S)-4,5-diacetoxy-6-bromo-6-cyano-tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(3R,4R,5S,6S)-4,5-diacetyloxy-6-bromo-6-cyano-3-oxanyl] ester IUPAC Name: [(3R,4R,5S,6S)-4,5-diacetyloxy-6-bromo-6-cyanooxan-3-yl] acetate Traditional Name: acetic acid [(3R,4R,5S,6S)-4,5-diacetoxy-6-bromo-6-cyano-tetrahydropyran-3-yl] ester Formula: C12H14BrNO7 MolecularWeight: 364.14606

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)(C#N)Br

Isomeric SMILES

CC(=O)O[C@@H]1CO[C@@]([C@H]([C@@H]1OC(=O)C)OC(=O)C)(C#N)Br

InChI

InChI=1S/C12H14BrNO7/c1-6(15)19-9-4-18-12(13,5-14)11(21-8(3)17)10(9)20-7(2)16/h9-11H,4H2,1-3H3/t9-,10-,11+,12-/m1/s1