| SpectraBase Spectrum ID |
LmG2FwnawGJ |
| Name |
1-{[(2-oxo-4-propyl-2H-1-benzopyran-7-yl)oxy]acetyl}-2-[(alpha,alpha,alpha-trifluoro-m-tolyl)sulfonyl]hydrazine |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
484.091591997 u |
| Formula |
C21H19F3N2O6S |
| InChI |
InChI=1S/C21H19F3N2O6S/c1-2-4-13-9-20(28)32-18-11-15(7-8-17(13)18)31-12-19(27)25-26-33(29,30)16-6-3-5-14(10-16)21(22,23)24/h3,5-11,26H,2,4,12H2,1H3,(H,25,27) |
| InChIKey |
BKAIJSJLKNAYLC-UHFFFAOYSA-N |
| Molecular Weight |
484.446 g/mol |
| SMILES |
N(C(COC1=CC=2OC(C=C(C2C=C1)CCC)=O)=O)NS(C1=CC(=CC=C1)C(F)(F)F)(=O)=O |
![1-{[(2-oxo-4-propyl-2H-1-benzopyran-7-yl)oxy]acetyl}-2-[(alpha,alpha,alpha-trifluoro-m-tolyl)sulfonyl]hydrazine](/api/spectrum/LmG2FwnawGJ/structure.png?h=300&w=458 "1-{[(2-oxo-4-propyl-2H-1-benzopyran-7-yl)oxy]acetyl}-2-[(alpha,alpha,alpha-trifluoro-m-tolyl)sulfonyl]hydrazine")
