| SpectraBase Spectrum ID |
5MxmcwkCLnq |
| Name |
Ethyl 3-[(4-chloro-2-fluoroanilino)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
325.062947151 u |
| Formula |
C14H13ClFN3O3 |
| InChI |
InChI=1S/C14H13ClFN3O3/c1-3-22-14(21)12-7-11(18-19(12)2)13(20)17-10-5-4-8(15)6-9(10)16/h4-7H,3H2,1-2H3,(H,17,20) |
| InChIKey |
WIWCUTXWQYNUGO-UHFFFAOYSA-N |
| Molecular Weight |
325.727 g/mol |
| SMILES |
N(C(C=1C=C(N(N1)C)C(=O)OCC)=O)C=1C(=CC(=CC1)Cl)F |
![ethyl 3-[(4-chloro-2-fluoroanilino)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate](/api/spectrum/5MxmcwkCLnq/structure.png?h=300&w=458 "ethyl 3-[(4-chloro-2-fluoroanilino)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate")
