tert-butyl (2S,3R)-2-methanoyl-3-[4-(trifluoromethylsulfonyloxy)phenyl]aziridine-1-carboxylate

Systemtic Name: tert-butyl (2S,3R)-2-methanoyl-3-[4-(trifluoromethylsulfonyloxy)phenyl]aziridine-1-carboxylate Openeye Name: tert-butyl (2S,3R)-2-formyl-3-[4-(trifluoromethylsulfonyloxy)phenyl]aziridine-1-carboxylate CAS Name: (2S,3R)-2-formyl-3-[4-(trifluoromethylsulfonyloxy)phenyl]-1-aziridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3R)-2-formyl-3-[4-(trifluoromethylsulfonyloxy)phenyl]aziridine-1-carboxylate Traditional Name: (2S,3R)-2-formyl-3-(4-triflyloxyphenyl)ethylenimine-1-carboxylic acid tert-butyl ester Formula: C15H16F3NO6S MolecularWeight: 395.35085

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(C1C2=CC=C(C=C2)OS(=O)(=O)C(F)(F)F)C=O

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@@H]([C@H]1C2=CC=C(C=C2)OS(=O)(=O)C(F)(F)F)C=O

InChI

InChI=1S/C15H16F3NO6S/c1-14(2,3)24-13(21)19-11(8-20)12(19)9-4-6-10(7-5-9)25-26(22,23)15(16,17)18/h4-8,11-12H,1-3H3/t11-,12-,19?/m1/s1