| SpectraBase Spectrum ID |
Es9TsXaMfk6 |
| Name |
Butanoic acid, 4-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-4-oxo-, 2-(4-methylphenyl)-2-oxoethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
427.079820216 u |
| Formula |
C20H17ClF3NO4 |
| InChI |
InChI=1S/C20H17ClF3NO4/c1-12-2-4-13(5-3-12)17(26)11-29-19(28)9-8-18(27)25-16-10-14(20(22,23)24)6-7-15(16)21/h2-7,10H,8-9,11H2,1H3,(H,25,27) |
| InChIKey |
VZFVQAQGVGXGFF-UHFFFAOYSA-N |
| Molecular Weight |
427.807 g/mol |
| SMILES |
N(C=1C=C(C(F)(F)F)C=CC1Cl)C(=O)CCC(OCC(C1=CC=C(C=C1)C)=O)=O |
![Butanoic acid, 4-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-4-oxo-, 2-(4-methylphenyl)-2-oxoethyl ester](/api/spectrum/Es9TsXaMfk6/structure.png?h=300&w=458 "Butanoic acid, 4-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-4-oxo-, 2-(4-methylphenyl)-2-oxoethyl ester")
