methyl 5-bromanyl-4-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethanoylamino]pentanoate

Systemtic Name: methyl 5-bromanyl-4-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethanoylamino]pentanoate Openeye Name: methyl 5-bromo-4-oxo-2-[(2,2,2-trifluoroacetyl)amino]pentanoate CAS Name: 5-bromo-4-oxo-2-[(2,2,2-trifluoro-1-oxoethyl)amino]pentanoic acid methyl ester IUPAC Name: methyl 5-bromo-4-oxo-2-[(2,2,2-trifluoroacetyl)amino]pentanoate Traditional Name: 5-bromo-4-keto-2-[(2,2,2-trifluoroacetyl)amino]valeric acid methyl ester Formula: C8H9BrF3NO4 MolecularWeight: 320.06057

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(=O)CBr)NC(=O)C(F)(F)F

Isomeric SMILES

COC(=O)C(CC(=O)CBr)NC(=O)C(F)(F)F

InChI

InChI=1S/C8H9BrF3NO4/c1-17-6(15)5(2-4(14)3-9)13-7(16)8(10,11)12/h5H,2-3H2,1H3,(H,13,16)