SpectraBase Spectrum ID |
3CbaQ2GCYFG |
Name |
N-[2-(4-Benzoyl-1-piperazinyl)phenyl]-2,2,2-trichloroacetamide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
425.046459930 u |
Formula |
C19H18Cl3N3O2 |
InChI |
InChI=1S/C19H18Cl3N3O2/c20-19(21,22)18(27)23-15-8-4-5-9-16(15)24-10-12-25(13-11-24)17(26)14-6-2-1-3-7-14/h1-9H,10-13H2,(H,23,27) |
InChIKey |
MCGFBDJSJQAZHY-UHFFFAOYSA-N |
SMILES |
N(C(C(Cl)(Cl)Cl)=O)C1=C(N2CCN(C(=O)C3=CC=CC=C3)CC2)C=CC=C1 |