[(1S,4R,5S,6R)-4,5,6-triacetyloxy-3-iodanyl-cyclohex-2-en-1-yl] ethanoate

Systemtic Name: [(1S,4R,5S,6R)-4,5,6-triacetyloxy-3-iodanyl-cyclohex-2-en-1-yl] ethanoate Openeye Name: [(1S,4R,5S,6R)-4,5,6-triacetoxy-3-iodo-cyclohex-2-en-1-yl] acetate CAS Name: acetic acid [(1S,4R,5S,6R)-4,5,6-triacetyloxy-3-iodo-1-cyclohex-2-enyl] ester IUPAC Name: [(1S,4R,5S,6R)-4,5,6-triacetyloxy-3-iodocyclohex-2-en-1-yl] acetate Traditional Name: acetic acid [(1S,4R,5S,6R)-4,5,6-triacetoxy-3-iodo-cyclohex-2-en-1-yl] ester Formula: C14H17IO8 MolecularWeight: 440.18445

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C=C(C(C(C1OC(=O)C)OC(=O)C)OC(=O)C)I

Isomeric SMILES

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

InChI

InChI=1S/C14H17IO8/c1-6(16)20-11-5-10(15)12(21-7(2)17)14(23-9(4)19)13(11)22-8(3)18/h5,11-14H,1-4H3/t11-,12-,13+,14+/m0/s1