alanine, N-(5-chloro-2-pyridinyl)-3,3,3-trifluoro-2-[(2-fluorobenzoyl)amino]-, methyl ester

SpectraBase Compound ID	Bn5aIPsnPjI
InChI	InChI=1S/C16H12ClF4N3O3/c1-27-14(26)15(16(19,20)21,23-12-7-6-9(17)8-22-12)24-13(25)10-4-2-3-5-11(10)18/h2-8H,1H3,(H,22,23)(H,24,25)
InChIKey	AIDWXACDVQZZJF-UHFFFAOYSA-N Google Search
Mol Weight	405.74 g/mol
Molecular Formula	C16H12ClF4N3O3
Exact Mass	405.050332 g/mol

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SpectraBase Spectrum ID	8nPHEojxa2C
Name	2-(5-Chloro-pyridin-2-ylamino)-3,3,3-trifluoro-2-(2-fluoro-benzoylamino)-propionic acid methyl ester
Alternate Name(s)	2-[(5-chloro-2-pyridinyl)amino]-3,3,3-trifluoro-2-[[(2-fluorophenyl)-oxomethyl]amino]propanoic acid methyl ester 2-[(5-chloro-2-pyridyl)amino]-3,3,3-trifluoro-2-[(2-fluorobenzoyl)amino]propionic acid methyl ester Methyl 2-[(5-chloranylpyridin-2-yl)amino]-3,3,3-tris(fluoranyl)-2-[(2-fluorophenyl)carbonylamino]propanoate Methyl 2-[(5-chloro-2-pyridinyl)amino]-3,3,3-trifluoro-2-[(2-fluorobenzoyl)amino]propanoate Methyl 2-[(5-chloro-2-pyridyl)amino]-3,3,3-trifluoro-2-[(2-fluorobenzoyl)amino]propanoate Methyl 2-[(5-chloropyridin-2-yl)amino]-3,3,3-trifluoro-2-[(2-fluorobenzoyl)amino]propanoate
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Formula	C16H12ClF4N3O3
InChI	InChI=1S/C16H12ClF4N3O3/c1-27-14(26)15(16(19,20)21,23-12-7-6-9(17)8-22-12)24-13(25)10-4-2-3-5-11(10)18/h2-8H,1H3,(H,22,23)(H,24,25)
InChIKey	AIDWXACDVQZZJF-UHFFFAOYSA-N
Molecular Weight	405.737 g/mol
SMILES	N(C(C(F)(F)F)(Nc1ncc(cc1)Cl)C(=O)OC)C(c1c(F)cccc1)=O
SPLASH	splash10-00di-3900000000-ec084a7db8fb7dbe342a
Wiley ID	1463321