[(2-methylpropan-2-yl)oxycarbonylamino] 2-[4-(trifluoromethylsulfonyloxy)phenyl]ethanoate

Systemtic Name: [(2-methylpropan-2-yl)oxycarbonylamino] 2-[4-(trifluoromethylsulfonyloxy)phenyl]ethanoate Openeye Name: (tert-butoxycarbonylamino) 2-[4-(trifluoromethylsulfonyloxy)phenyl]acetate CAS Name: 2-[4-(trifluoromethylsulfonyloxy)phenyl]acetic acid [[(2-methylpropan-2-yl)oxy-oxomethyl]amino] ester IUPAC Name: [(2-methylpropan-2-yl)oxycarbonylamino] 2-[4-(trifluoromethylsulfonyloxy)phenyl]acetate Traditional Name: 2-(4-triflyloxyphenyl)acetic acid (tert-butoxycarbonylamino) ester Formula: C14H16F3NO7S MolecularWeight: 399.33955

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NOC(=O)CC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)NOC(=O)CC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F

InChI

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