[(3S,4S,5R,6R)-4,5-diacetyloxy-6-(2-nitroimidazol-1-yl)oxan-3-yl] ethanoate

Systemtic Name: [(3S,4S,5R,6R)-4,5-diacetyloxy-6-(2-nitroimidazol-1-yl)oxan-3-yl] ethanoate Openeye Name: [(3S,4S,5R,6R)-4,5-diacetoxy-6-(2-nitroimidazol-1-yl)tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(3S,4S,5R,6R)-4,5-diacetyloxy-6-(2-nitro-1-imidazolyl)-3-oxanyl] ester IUPAC Name: [(3S,4S,5R,6R)-4,5-diacetyloxy-6-(2-nitroimidazol-1-yl)oxan-3-yl] acetate Traditional Name: acetic acid [(3S,4S,5R,6R)-4,5-diacetoxy-6-(2-nitroimidazol-1-yl)tetrahydropyran-3-yl] ester Formula: C14H17N3O9 MolecularWeight: 371.29948

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)N2C=CN=C2[N+](=O)[O-]

Isomeric SMILES

CC(=O)O[C@H]1CO[C@H]([C@@H]([C@H]1OC(=O)C)OC(=O)C)N2C=CN=C2[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O9/c1-7(18)24-10-6-23-13(16-5-4-15-14(16)17(21)22)12(26-9(3)20)11(10)25-8(2)19/h4-5,10-13H,6H2,1-3H3/t10-,11-,12+,13+/m0/s1