ethyl 2-({[(E)-amino(4-pyridinyl)methylidene]amino}oxy)-3,3,3-trifluoro-2-(pentanoylamino)propanoate

SpectraBase Compound ID	6JOJJeo4Auk
InChI	InChI=1S/C16H21F3N4O4/c1-3-5-6-12(24)22-15(16(17,18)19,14(25)26-4-2)27-23-13(20)11-7-9-21-10-8-11/h7-10H,3-6H2,1-2H3,(H2,20,23)(H,22,24)
InChIKey	MIRXCTGOCGHKJI-UHFFFAOYSA-N Google Search
Mol Weight	390.36 g/mol
Molecular Formula	C16H21F3N4O4
Exact Mass	390.15149 g/mol

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SpectraBase Spectrum ID	8jabZpnwuNK
Name	Propanoic acid, 2-[[(amino4-pyridinylmethylidene)amino]oxy]-3,3,3-trifluoro-2-[(1-oxopentyl)amino]-, ethyl ester
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H21F3N4O4
InChI	InChI=1S/C16H21F3N4O4/c1-3-5-6-12(24)22-15(16(17,18)19,14(25)26-4-2)27-23-13(20)11-7-9-21-10-8-11/h7-10H,3-6H2,1-2H3,(H2,20,23)(H,22,24)
InChIKey	MIRXCTGOCGHKJI-UHFFFAOYSA-N
Molecular Weight	390.363 g/mol
SMILES	N(C(=O)CCCC)C(O\N=C\(N)c1ccncc1)(C(OCC)=O)C(F)(F)F
SPLASH	splash10-052r-9600000000-0533015b946b46cfae9c
Source of Spectrum	IY-2-4887-2
Synonyms	2-[[amino(pyridin-4-yl)methylidene]amino]oxy-3,3,3-trifluoro-2-(1-oxopentylamino)propanoic acid ethyl ester Ethyl 2-[[amino(pyridin-4-yl)methylidene]amino]oxy-3,3,3-trifluoro-2-(pentanoylamino)propanoate Ethyl 2-[[amino(4-pyridyl)methylene]amino]oxy-3,3,3-trifluoro-2-(pentanoylamino)propanoate Ethyl 2-[[azanyl(pyridin-4-yl)methylidene]amino]oxy-3,3,3-tris(fluoranyl)-2-(pentanoylamino)propanoate
Wiley ID	1656629