tert-butyl (2S,4S,5R,6R)-5-acetamido-4-nitro-2-oxidanyl-6-[(1R,2R)-1,2,3-tris(oxidanyl)propyl]oxane-2-carboxylate

Systemtic Name: tert-butyl (2S,4S,5R,6R)-5-acetamido-4-nitro-2-oxidanyl-6-[(1R,2R)-1,2,3-tris(oxidanyl)propyl]oxane-2-carboxylate Openeye Name: tert-butyl (2S,4S,5R,6R)-5-acetamido-2-hydroxy-4-nitro-6-[(1R,2R)-1,2,3-trihydroxypropyl]tetrahydropyran-2-carboxylate CAS Name: (2S,4S,5R,6R)-5-acetamido-2-hydroxy-4-nitro-6-[(1R,2R)-1,2,3-trihydroxypropyl]-2-oxanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,4S,5R,6R)-5-acetamido-2-hydroxy-4-nitro-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylate Traditional Name: (2S,4S,5R,6R)-5-acetamido-2-hydroxy-4-nitro-6-[(1R,2R)-1,2,3-trihydroxypropyl]tetrahydropyran-2-carboxylic acid tert-butyl ester Formula: C15H26N2O10 MolecularWeight: 394.37434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(CC(OC1C(C(CO)O)O)(C(=O)OC(C)(C)C)O)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N[C@@H]1[C@H](C[C@](O[C@H]1[C@@H]([C@@H](CO)O)O)(C(=O)OC(C)(C)C)O)[N+](=O)[O-]

InChI

InChI=1S/C15H26N2O10/c1-7(19)16-10-8(17(24)25)5-15(23,13(22)27-14(2,3)4)26-12(10)11(21)9(20)6-18/h8-12,18,20-21,23H,5-6H2,1-4H3,(H,16,19)/t8-,9+,10+,11+,12+,15-/m0/s1