| SpectraBase Spectrum ID |
IWR3Q5f7EbN |
| Name |
o-{[2-(2-Pyridyl)-6-(trifluoromethyl)-4-pyrimidinyl]oxy}benzoic acid, methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
375.083075744 u |
| Formula |
C18H12F3N3O3 |
| InChI |
InChI=1S/C18H12F3N3O3/c1-26-17(25)11-6-2-3-8-13(11)27-15-10-14(18(19,20)21)23-16(24-15)12-7-4-5-9-22-12/h2-10H,1H3 |
| InChIKey |
FMPBOTNGJTZASP-UHFFFAOYSA-N |
| Molecular Weight |
375.307 g/mol |
| SMILES |
COC(C1=CC=CC=C1OC1=NC(=NC(=C1)C(F)(F)F)C1=NC=CC=C1)=O |
![o-{[2-(2-Pyridyl)-6-(trifluoromethyl)-4-pyrimidinyl]oxy}benzoic acid, methyl ester](/api/spectrum/IWR3Q5f7EbN/structure.png?h=300&w=458 "o-{[2-(2-Pyridyl)-6-(trifluoromethyl)-4-pyrimidinyl]oxy}benzoic acid, methyl ester")
