tert-butyl 2-(phenylmethoxycarbonylamino)-3-[4-(trifluoromethylsulfonyloxy)phenyl]propanoate

Systemtic Name: tert-butyl 2-(phenylmethoxycarbonylamino)-3-[4-(trifluoromethylsulfonyloxy)phenyl]propanoate Openeye Name: tert-butyl 2-(benzyloxycarbonylamino)-3-[4-(trifluoromethylsulfonyloxy)phenyl]propanoate CAS Name: 2-(phenylmethoxycarbonylamino)-3-[4-(trifluoromethylsulfonyloxy)phenyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-(phenylmethoxycarbonylamino)-3-[4-(trifluoromethylsulfonyloxy)phenyl]propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-(4-triflyloxyphenyl)propionic acid tert-butyl ester Formula: C22H24F3NO7S MolecularWeight: 503.48867

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)C(CC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H24F3NO7S/c1-21(2,3)32-19(27)18(26-20(28)31-14-16-7-5-4-6-8-16)13-15-9-11-17(12-10-15)33-34(29,30)22(23,24)25/h4-12,18H,13-14H2,1-3H3,(H,26,28)