[(2R,3R,4R,5R)-5-acetyloxy-6-bromanyl-2,4-dimethyl-3-oxidanyl-hexyl] ethanoate

Systemtic Name: [(2R,3R,4R,5R)-5-acetyloxy-6-bromanyl-2,4-dimethyl-3-oxidanyl-hexyl] ethanoate Openeye Name: [(2R,3R,4R,5R)-5-acetoxy-6-bromo-3-hydroxy-2,4-dimethyl-hexyl] acetate CAS Name: acetic acid [(2R,3R,4R,5R)-5-acetyloxy-6-bromo-3-hydroxy-2,4-dimethylhexyl] ester IUPAC Name: [(2R,3R,4R,5R)-5-acetyloxy-6-bromo-3-hydroxy-2,4-dimethylhexyl] acetate Traditional Name: acetic acid [(2R,3R,4R,5R)-5-acetoxy-6-bromo-3-hydroxy-2,4-dimethyl-hexyl] ester Formula: C12H21BrO5 MolecularWeight: 325.19614

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)C)C(C(C)C(CBr)OC(=O)C)O

Isomeric SMILES

C[C@H](COC(=O)C)[C@H]([C@@H](C)[C@H](CBr)OC(=O)C)O

InChI

InChI=1S/C12H21BrO5/c1-7(6-17-9(3)14)12(16)8(2)11(5-13)18-10(4)15/h7-8,11-12,16H,5-6H2,1-4H3/t7-,8+,11+,12-/m1/s1