SpectraBase Spectrum ID |
JZXHIxYK1we |
Name |
6-Bromanyl-N-[2-[2-methyl-5-(trifluoromethyloxy)-1H-indol-3-yl]ethyl]-2-oxidanylidene-chromene-3-carboxamide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
508.024554488 u |
Formula |
C22H16BrF3N2O4 |
InChI |
InChI=1S/C22H16BrF3N2O4/c1-11-15(16-10-14(32-22(24,25)26)3-4-18(16)28-11)6-7-27-20(29)17-9-12-8-13(23)2-5-19(12)31-21(17)30/h2-5,8-10,28H,6-7H2,1H3,(H,27,29) |
InChIKey |
RGOWWNXYECSGKN-UHFFFAOYSA-N |
Molecular Weight |
509.279 g/mol |
SMILES |
C=1(C(OC2=C(C1)C=C(C=C2)Br)=O)C(=O)NCCC1=C(NC=2C1=CC(OC(F)(F)F)=CC2)C |