2-[(2-methylpropan-2-yl)oxycarbonyl-[4-(trifluoromethylsulfonyloxy)phenyl]amino]ethanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonyl-[4-(trifluoromethylsulfonyloxy)phenyl]amino]ethanoic acid Openeye Name: 2-[N-tert-butoxycarbonyl-4-(trifluoromethylsulfonyloxy)anilino]acetic acid CAS Name: 2-[N-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-(trifluoromethylsulfonyloxy)anilino]acetic acid IUPAC Name: 2-[N-[(2-methylpropan-2-yl)oxycarbonyl]-4-(trifluoromethylsulfonyloxy)anilino]acetic acid Traditional Name: 2-(N-tert-butoxycarbonyl-4-triflyloxy-anilino)acetic acid Formula: C14H16F3NO7S MolecularWeight: 399.33955

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC(=O)O)C1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N(CC(=O)O)C1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C14H16F3NO7S/c1-13(2,3)24-12(21)18(8-11(19)20)9-4-6-10(7-5-9)25-26(22,23)14(15,16)17/h4-7H,8H2,1-3H3,(H,19,20)