propan-2-yl (2S,3S,4R,5R,6S)-6-acetyloxy-5-iodanyl-2,4-dimethyl-4-oxidanyl-oxane-3-carboxylate

Systemtic Name: propan-2-yl (2S,3S,4R,5R,6S)-6-acetyloxy-5-iodanyl-2,4-dimethyl-4-oxidanyl-oxane-3-carboxylate Openeye Name: isopropyl (2S,3S,4R,5R,6S)-6-acetoxy-4-hydroxy-5-iodo-2,4-dimethyl-tetrahydropyran-3-carboxylate CAS Name: (2S,3S,4R,5R,6S)-6-acetyloxy-4-hydroxy-5-iodo-2,4-dimethyl-3-oxanecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (2S,3S,4R,5R,6S)-6-acetyloxy-4-hydroxy-5-iodo-2,4-dimethyloxane-3-carboxylate Traditional Name: (2S,3S,4R,5R,6S)-6-acetoxy-4-hydroxy-5-iodo-2,4-dimethyl-tetrahydropyran-3-carboxylic acid isopropyl ester Formula: C13H21IO6 MolecularWeight: 400.20671

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OC(=O)C)I)(C)O)C(=O)OC(C)C

Isomeric SMILES

C[C@H]1[C@@H]([C@@]([C@H]([C@@H](O1)OC(=O)C)I)(C)O)C(=O)OC(C)C

InChI

InChI=1S/C13H21IO6/c1-6(2)18-11(16)9-7(3)19-12(20-8(4)15)10(14)13(9,5)17/h6-7,9-10,12,17H,1-5H3/t7-,9+,10-,12-,13+/m0/s1