propan-2-yl (2S,3S,4R)-4-(azidomethyl)-3-(trifluoromethylsulfonyloxy)oxetane-2-carboxylate

Systemtic Name: propan-2-yl (2S,3S,4R)-4-(azidomethyl)-3-(trifluoromethylsulfonyloxy)oxetane-2-carboxylate Openeye Name: isopropyl (2S,3S,4R)-4-(azidomethyl)-3-(trifluoromethylsulfonyloxy)oxetane-2-carboxylate CAS Name: (2S,3S,4R)-4-(azidomethyl)-3-(trifluoromethylsulfonyloxy)-2-oxetanecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (2S,3S,4R)-4-(azidomethyl)-3-(trifluoromethylsulfonyloxy)oxetane-2-carboxylate Traditional Name: (2S,3S,4R)-4-(azidomethyl)-3-triflyloxy-oxetane-2-carboxylic acid isopropyl ester Formula: C9H12F3N3O6S MolecularWeight: 347.26829

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1C(C(O1)CN=[N+]=[N-])OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC(C)OC(=O)[C@@H]1[C@H]([C@H](O1)CN=[N+]=[N-])OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C9H12F3N3O6S/c1-4(2)19-8(16)7-6(5(20-7)3-14-15-13)21-22(17,18)9(10,11)12/h4-7H,3H2,1-2H3/t5-,6+,7+/m1/s1