tert-butyl 2-fluoranyl-4-[2,2,2-tris(fluoranyl)ethanoylamino]benzoate

Systemtic Name: tert-butyl 2-fluoranyl-4-[2,2,2-tris(fluoranyl)ethanoylamino]benzoate Openeye Name: tert-butyl 2-fluoro-4-[(2,2,2-trifluoroacetyl)amino]benzoate CAS Name: 2-fluoro-4-[(2,2,2-trifluoro-1-oxoethyl)amino]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-fluoro-4-[(2,2,2-trifluoroacetyl)amino]benzoate Traditional Name: 2-fluoro-4-[(2,2,2-trifluoroacetyl)amino]benzoic acid tert-butyl ester Formula: C13H13F4NO3 MolecularWeight: 307.240833

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(C=C(C=C1)NC(=O)C(F)(F)F)F

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C=C(C=C1)NC(=O)C(F)(F)F)F

InChI

InChI=1S/C13H13F4NO3/c1-12(2,3)21-10(19)8-5-4-7(6-9(8)14)18-11(20)13(15,16)17/h4-6H,1-3H3,(H,18,20)