SpectraBase Spectrum ID |
EilZD4GNXLN |
Name |
3,4,5-Trimethoxy-N-[2-[2-methyl-5-(trifluoromethyloxy)-1H-indol-3-yl]ethyl]benzamide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
452.155906333 u |
Formula |
C22H23F3N2O5 |
InChI |
InChI=1S/C22H23F3N2O5/c1-12-15(16-11-14(32-22(23,24)25)5-6-17(16)27-12)7-8-26-21(28)13-9-18(29-2)20(31-4)19(10-13)30-3/h5-6,9-11,27H,7-8H2,1-4H3,(H,26,28) |
InChIKey |
YDRZYQMRGLCYBG-UHFFFAOYSA-N |
Molecular Weight |
452.430 g/mol |
SMILES |
COC=1C(OC)=C(C=C(C(NCCC2=C(NC=3C2=CC(OC(F)(F)F)=CC3)C)=O)C1)OC |