SpectraBase Spectrum ID |
GPPxMNtP4DT |
Name |
2-Chloranyl-N-[2-[2-methyl-5-(trifluoromethyloxy)-1H-indol-3-yl]ethyl]pyridine-3-carboxamide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
397.080488922 u |
Formula |
C18H15ClF3N3O2 |
InChI |
InChI=1S/C18H15ClF3N3O2/c1-10-12(6-8-24-17(26)13-3-2-7-23-16(13)19)14-9-11(27-18(20,21)22)4-5-15(14)25-10/h2-5,7,9,25H,6,8H2,1H3,(H,24,26) |
InChIKey |
WBPBZJALVPENLT-UHFFFAOYSA-N |
Molecular Weight |
397.785 g/mol |
SMILES |
C1=CN=C(C(C(NCCC2=C(NC=3C2=CC(OC(F)(F)F)=CC3)C)=O)=C1)Cl |