[(3R,4R,5S,6S)-4,5-diacetyloxy-6-azido-6-cyano-oxan-3-yl] ethanoate

Systemtic Name: [(3R,4R,5S,6S)-4,5-diacetyloxy-6-azido-6-cyano-oxan-3-yl] ethanoate Openeye Name: [(3R,4R,5S,6S)-4,5-diacetoxy-6-azido-6-cyano-tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(3R,4R,5S,6S)-4,5-diacetyloxy-6-azido-6-cyano-3-oxanyl] ester IUPAC Name: [(3R,4R,5S,6S)-4,5-diacetyloxy-6-azido-6-cyanooxan-3-yl] acetate Traditional Name: acetic acid [(3R,4R,5S,6S)-4,5-diacetoxy-6-azido-6-cyano-tetrahydropyran-3-yl] ester Formula: C12H14N4O7 MolecularWeight: 326.26216

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)(C#N)N=[N+]=[N-]

Isomeric SMILES

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

InChI

InChI=1S/C12H14N4O7/c1-6(17)21-9-4-20-12(5-13,15-16-14)11(23-8(3)19)10(9)22-7(2)18/h9-11H,4H2,1-3H3/t9-,10-,11+,12+/m1/s1