SpectraBase Spectrum ID |
2KSShIna5Me |
Name |
N-(2-Bromo-4,6-difluorophenyl)-3-(1,3-dioxooctahydro-2H-isoindol-2-yl)propanamide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
414.039061738 u |
Formula |
C17H17BrF2N2O3 |
InChI |
InChI=1S/C17H17BrF2N2O3/c18-12-7-9(19)8-13(20)15(12)21-14(23)5-6-22-16(24)10-3-1-2-4-11(10)17(22)25/h7-8,10-11H,1-6H2,(H,21,23) |
InChIKey |
NWYDFVJMFLQZDI-UHFFFAOYSA-N |
Molecular Weight |
415.235 g/mol |
SMILES |
N(C1=C(C=C(F)C=C1F)Br)C(CCN1C(C2CCCCC2C1=O)=O)=O |