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2-(4-Methylphenyl)-4-amino-3-[ethoxycarbonyl]-5-cyano-6-[(3-trifluoromethyl)phenoxy]-pyridine
SpectraBase Compound ID LF1NMWeVpRT
InChI InChI=1S/C23H18F3N3O3/c1-3-31-22(30)18-19(28)17(12-27)21(29-20(18)14-9-7-13(2)8-10-14)32-16-6-4-5-15(11-16)23(24,25)26/h4-11H,3H2,1-2H3,(H2,28,29)
InChIKey SYCHCTMFQIKGQD-UHFFFAOYSA-N
Mol Weight 441.41 g/mol
Molecular Formula C23H18F3N3O3
Exact Mass 441.130026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LavO45Z8nPk
Name 2-(4-Methylphenyl)-4-amino-3-[ethoxycarbonyl]-5-cyano-6-[(3-trifluoromethyl)phenoxy]-pyridine
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Formula C23H18F3N3O3
InChI InChI=1S/C23H18F3N3O3/c1-3-31-22(30)18-19(28)17(12-27)21(29-20(18)14-9-7-13(2)8-10-14)32-16-6-4-5-15(11-16)23(24,25)26/h4-11H,3H2,1-2H3,(H2,28,29)
InChIKey SYCHCTMFQIKGQD-UHFFFAOYSA-N
Molecular Weight 441.410 g/mol
SMILES Nc1c(c(Oc2cc(C(F)(F)F)ccc2)nc(c1C(=O)OCC)-c1ccc(cc1)C)C#N
SPLASH splash10-0296-0223900000-d3454e3e3caea8311533
Source of Spectrum Y-50-1041-5h
Synonyms Ethyl 4-amino-5-cyano-2-(p-tolyl)-6-(3-(trifluoromethyl)phenoxy)nicotinate 4-Amino-5-cyano-2-(4-methylphenyl)-6-[3-(trifluoromethyl)phenoxy]-3-pyridinecarboxylic acid ethyl ester Ethyl 4-amino-5-cyano-2-(4-methylphenyl)-6-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylate Ethyl 4-amino-5-cyano-2-(p-tolyl)-6-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylate Ethyl 4-azanyl-5-cyano-2-(4-methylphenyl)-6-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylate
Wiley ID 1736732