[(1S,2R,5S,6S)-6-acetyloxy-2,5-bis(bromanyl)-3-iodanyl-6-methyl-cyclohex-3-en-1-yl] ethanoate

Systemtic Name: [(1S,2R,5S,6S)-6-acetyloxy-2,5-bis(bromanyl)-3-iodanyl-6-methyl-cyclohex-3-en-1-yl] ethanoate Openeye Name: [(1S,2R,5S,6S)-6-acetoxy-2,5-dibromo-3-iodo-6-methyl-cyclohex-3-en-1-yl] acetate CAS Name: acetic acid [(1S,2R,5S,6S)-6-acetyloxy-2,5-dibromo-3-iodo-6-methyl-1-cyclohex-3-enyl] ester IUPAC Name: [(1S,2R,5S,6S)-6-acetyloxy-2,5-dibromo-3-iodo-6-methylcyclohex-3-en-1-yl] acetate Traditional Name: acetic acid [(1S,2R,5S,6S)-6-acetoxy-2,5-dibromo-3-iodo-6-methyl-cyclohex-3-en-1-yl] ester Formula: C11H13Br2IO4 MolecularWeight: 495.93099

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(=CC(C1(C)OC(=O)C)Br)I)Br

Isomeric SMILES

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

InChI

InChI=1S/C11H13Br2IO4/c1-5(15)17-10-9(13)7(14)4-8(12)11(10,3)18-6(2)16/h4,8-10H,1-3H3/t8-,9-,10+,11+/m0/s1