methyl (3R,4R,5R,6R)-3,4,5-triacetyloxy-6-(3-acetyloxy-5-iodanyl-phenoxy)oxane-2-carboxylate

Systemtic Name: methyl (3R,4R,5R,6R)-3,4,5-triacetyloxy-6-(3-acetyloxy-5-iodanyl-phenoxy)oxane-2-carboxylate Openeye Name: methyl (3R,4R,5R,6R)-3,4,5-triacetoxy-6-(3-acetoxy-5-iodo-phenoxy)tetrahydropyran-2-carboxylate CAS Name: (3R,4R,5R,6R)-3,4,5-triacetyloxy-6-(3-acetyloxy-5-iodophenoxy)-2-oxanecarboxylic acid methyl ester IUPAC Name: methyl (3R,4R,5R,6R)-3,4,5-triacetyloxy-6-(3-acetyloxy-5-iodophenoxy)oxane-2-carboxylate Traditional Name: (3R,4R,5R,6R)-3,4,5-triacetoxy-6-(3-acetoxy-5-iodo-phenoxy)tetrahydropyran-2-carboxylic acid methyl ester Formula: C21H23IO12 MolecularWeight: 594.30459

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(OC(C1OC(=O)C)OC2=CC(=CC(=C2)OC(=O)C)I)C(=O)OC)OC(=O)C

Isomeric SMILES

CC(=O)O[C@H]1[C@H]([C@H](OC([C@@H]1OC(=O)C)C(=O)OC)OC2=CC(=CC(=C2)OC(=O)C)I)OC(=O)C

InChI

InChI=1S/C21H23IO12/c1-9(23)29-14-6-13(22)7-15(8-14)33-21-19(32-12(4)26)17(31-11(3)25)16(30-10(2)24)18(34-21)20(27)28-5/h6-8,16-19,21H,1-5H3/t16-,17-,18?,19-,21+/m1/s1