| SpectraBase Spectrum ID |
89zVnQXOYhA |
| Name |
Propyl 4-({[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)benzoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
369.130025938 u |
| Formula |
C17H18F3N3O3 |
| InChI |
InChI=1S/C17H18F3N3O3/c1-3-8-26-16(25)12-4-6-13(7-5-12)21-15(24)10-23-11(2)9-14(22-23)17(18,19)20/h4-7,9H,3,8,10H2,1-2H3,(H,21,24) |
| InChIKey |
BPNVXFGTBGQYIO-UHFFFAOYSA-N |
| Molecular Weight |
369.344 g/mol |
| SMILES |
N(C(CN1N=C(C=C1C)C(F)(F)F)=O)C=1C=CC(C(=O)OCCC)=CC1 |
![propyl 4-({[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)benzoate](/api/spectrum/89zVnQXOYhA/structure.png?h=300&w=458 "propyl 4-({[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)benzoate")
