[(2R,3R,4S,5S,6R)-4,5-diacetyloxy-6-(acetyloxymethyl)-2-bromanyl-oxan-3-yl] 2-chloranylethanoate

Systemtic Name: [(2R,3R,4S,5S,6R)-4,5-diacetyloxy-6-(acetyloxymethyl)-2-bromanyl-oxan-3-yl] 2-chloranylethanoate Openeye Name: [(2R,3R,4S,5S,6R)-4,5-diacetoxy-6-(acetoxymethyl)-2-bromo-tetrahydropyran-3-yl] 2-chloroacetate CAS Name: 2-chloroacetic acid [(2R,3R,4S,5S,6R)-4,5-diacetyloxy-6-(acetyloxymethyl)-2-bromo-3-oxanyl] ester IUPAC Name: [(2R,3R,4S,5S,6R)-4,5-diacetyloxy-6-(acetyloxymethyl)-2-bromooxan-3-yl] 2-chloroacetate Traditional Name: 2-chloroacetic acid [(2R,3R,4S,5S,6R)-4,5-diacetoxy-6-(acetoxymethyl)-2-bromo-tetrahydropyran-3-yl] ester Formula: C14H18BrClO9 MolecularWeight: 445.64432

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)Br)OC(=O)CCl)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)Br)OC(=O)CCl)OC(=O)C)OC(=O)C

InChI

InChI=1S/C14H18BrClO9/c1-6(17)21-5-9-11(22-7(2)18)12(23-8(3)19)13(14(15)24-9)25-10(20)4-16/h9,11-14H,4-5H2,1-3H3/t9-,11+,12+,13-,14+/m1/s1