SpectraBase Spectrum ID |
DpQ7cChyTLh |
Name |
2-{4-(p-Chlorophenyl)-4-[2-(diethflamino)ethoxy]piperidino}-6'-methyl-o-acetotoluidide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
471.265255174 u |
Formula |
C27H38ClN3O2 |
InChI |
InChI=1S/C27H38ClN3O2/c1-5-30(6-2)18-19-33-27(23-10-12-24(28)13-11-23)14-16-31(17-15-27)20-25(32)29-26-21(3)8-7-9-22(26)4/h7-13H,5-6,14-20H2,1-4H3,(H,29,32) |
InChIKey |
IWVFYKAQXZFRLD-UHFFFAOYSA-N |
Molecular Weight |
472.073 g/mol |
SMILES |
N(C1=C(C=CC=C1C)C)C(CN1CCC(CC1)(C=1C=CC(=CC1)Cl)OCCN(CC)CC)=O |
Spectrum/Structure Validation Score (Raman) |
0.909443 |