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

Systemtic Name: methyl (3R,4R,5R,6R)-3,4,5-triacetyloxy-6-(3-iodanyl-5-oxidanyl-phenoxy)oxane-2-carboxylate Openeye Name: methyl (3R,4R,5R,6R)-3,4,5-triacetoxy-6-(3-hydroxy-5-iodo-phenoxy)tetrahydropyran-2-carboxylate CAS Name: (3R,4R,5R,6R)-3,4,5-triacetyloxy-6-(3-hydroxy-5-iodophenoxy)-2-oxanecarboxylic acid methyl ester IUPAC Name: methyl (3R,4R,5R,6R)-3,4,5-triacetyloxy-6-(3-hydroxy-5-iodophenoxy)oxane-2-carboxylate Traditional Name: (3R,4R,5R,6R)-3,4,5-triacetoxy-6-(3-hydroxy-5-iodo-phenoxy)tetrahydropyran-2-carboxylic acid methyl ester Formula: C19H21IO11 MolecularWeight: 552.26791

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C19H21IO11/c1-8(21)27-14-15(28-9(2)22)17(29-10(3)23)19(31-16(14)18(25)26-4)30-13-6-11(20)5-12(24)7-13/h5-7,14-17,19,24H,1-4H3/t14-,15-,16?,17-,19+/m1/s1