SpectraBase Spectrum ID |
AH2xf1omoQy |
Name |
1-[5-(p-Chlorophenoxy)-2-(2,4-dichlorophenyl)pentyl]imidazole, oxalate(1:1) |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
498.051604879 u |
Formula |
C22H21Cl3N2O5 |
InChI |
InChI=1S/C20H19Cl3N2O.C2H2O4/c21-16-3-6-18(7-4-16)26-11-1-2-15(13-25-10-9-24-14-25)19-8-5-17(22)12-20(19)23;3-1(4)2(5)6/h3-10,12,14-15H,1-2,11,13H2;(H,3,4)(H,5,6) |
InChIKey |
VUVSJXDBMXCFEQ-UHFFFAOYSA-N |
Molecular Weight |
499.778 g/mol |
SMILES |
C=1C(=C(C=C(C1)Cl)Cl)C(CCCOC=1C=CC(=CC1)Cl)CN1C=CN=C1.OC(C(O)=O)=O |