methyl (2S,4S,5R)-5-acetamido-6-[(1R,2S)-3-iodanyl-1,2-bis(oxidanyl)propyl]-2,4-bis(oxidanyl)oxane-2-carboxylate

Systemtic Name: methyl (2S,4S,5R)-5-acetamido-6-[(1R,2S)-3-iodanyl-1,2-bis(oxidanyl)propyl]-2,4-bis(oxidanyl)oxane-2-carboxylate Openeye Name: methyl (2S,4S,5R)-5-acetamido-6-[(1R,2S)-1,2-dihydroxy-3-iodo-propyl]-2,4-dihydroxy-tetrahydropyran-2-carboxylate CAS Name: (2S,4S,5R)-5-acetamido-6-[(1R,2S)-1,2-dihydroxy-3-iodopropyl]-2,4-dihydroxy-2-oxanecarboxylic acid methyl ester IUPAC Name: methyl (2S,4S,5R)-5-acetamido-6-[(1R,2S)-1,2-dihydroxy-3-iodopropyl]-2,4-dihydroxyoxane-2-carboxylate Traditional Name: (2S,4S,5R)-5-acetamido-6-[(1R,2S)-1,2-dihydroxy-3-iodo-propyl]-2,4-dihydroxy-tetrahydropyran-2-carboxylic acid methyl ester Formula: C12H20INO8 MolecularWeight: 433.19357

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(CC(OC1C(C(CI)O)O)(C(=O)OC)O)O

Isomeric SMILES

CC(=O)N[C@@H]1[C@H](C[C@](OC1[C@@H]([C@@H](CI)O)O)(C(=O)OC)O)O

InChI

InChI=1S/C12H20INO8/c1-5(15)14-8-6(16)3-12(20,11(19)21-2)22-10(8)9(18)7(17)4-13/h6-10,16-18,20H,3-4H2,1-2H3,(H,14,15)/t6-,7+,8+,9+,10?,12-/m0/s1