methyl 3-bromanyl-4-[2,2,2-tris(fluoranyl)ethanoylamino]benzoate

Systemtic Name: methyl 3-bromanyl-4-[2,2,2-tris(fluoranyl)ethanoylamino]benzoate Openeye Name: methyl 3-bromo-4-[(2,2,2-trifluoroacetyl)amino]benzoate CAS Name: 3-bromo-4-[(2,2,2-trifluoro-1-oxoethyl)amino]benzoic acid methyl ester IUPAC Name: methyl 3-bromo-4-[(2,2,2-trifluoroacetyl)amino]benzoate Traditional Name: 3-bromo-4-[(2,2,2-trifluoroacetyl)amino]benzoic acid methyl ester Formula: C10H7BrF3NO3 MolecularWeight: 326.06669

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)NC(=O)C(F)(F)F)Br

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)NC(=O)C(F)(F)F)Br

InChI

InChI=1S/C10H7BrF3NO3/c1-18-8(16)5-2-3-7(6(11)4-5)15-9(17)10(12,13)14/h2-4H,1H3,(H,15,17)