SpectraBase Spectrum ID |
90kLDXoBEBR |
Name |
2-Bromo-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
356.052426174 u |
Formula |
C18H17BrN2O |
InChI |
InChI=1S/C18H17BrN2O/c1-12-6-7-17-15(10-12)13(11-21-17)8-9-20-18(22)14-4-2-3-5-16(14)19/h2-7,10-11,21H,8-9H2,1H3,(H,20,22) |
InChIKey |
HNNPIQPIZAWZAM-UHFFFAOYSA-N |
Molecular Weight |
357.251 g/mol |
SMILES |
N(C(C1=C(Br)C=CC=C1)=O)CCC1=CNC2=C1C=C(C=C2)C |