[(2R,4S,5R)-4-[(1S)-1-acetyloxy-4-bromanyl-but-3-ynyl]-2-methyl-1,3-dioxan-5-yl] ethanoate

Systemtic Name: [(2R,4S,5R)-4-[(1S)-1-acetyloxy-4-bromanyl-but-3-ynyl]-2-methyl-1,3-dioxan-5-yl] ethanoate Openeye Name: [(2R,4S,5R)-4-[(1S)-1-acetoxy-4-bromo-but-3-ynyl]-2-methyl-1,3-dioxan-5-yl] acetate CAS Name: acetic acid [(2R,4S,5R)-4-[(1S)-1-acetyloxy-4-bromobut-3-ynyl]-2-methyl-1,3-dioxan-5-yl] ester IUPAC Name: [(2R,4S,5R)-4-[(1S)-1-acetyloxy-4-bromobut-3-ynyl]-2-methyl-1,3-dioxan-5-yl] acetate Traditional Name: acetic acid [(2R,4S,5R)-4-[(1S)-1-acetoxy-4-bromo-but-3-ynyl]-2-methyl-1,3-dioxan-5-yl] ester Formula: C13H17BrO6 MolecularWeight: 349.17448

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Descriptors Computed from Structure

Canonical SMILES:

CC1OCC(C(O1)C(CC#CBr)OC(=O)C)OC(=O)C

Isomeric SMILES

C[C@@H]1OC[C@H]([C@@H](O1)[C@H](CC#CBr)OC(=O)C)OC(=O)C

InChI

InChI=1S/C13H17BrO6/c1-8(15)18-11(5-4-6-14)13-12(19-9(2)16)7-17-10(3)20-13/h10-13H,5,7H2,1-3H3/t10-,11+,12-,13+/m1/s1