| SpectraBase Spectrum ID |
2vJw6SGxLDg |
| Name |
(4Z)-4-[2-(4-Chlorobenzyl)oxybenzylidene]-5-methyl-2-(4-nitrophenyl)-2-pyrazolin-3-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
447.098583768 u |
| Formula |
C24H18ClN3O4 |
| InChI |
InChI=1S/C24H18ClN3O4/c1-16-22(24(29)27(26-16)20-10-12-21(13-11-20)28(30)31)14-18-4-2-3-5-23(18)32-15-17-6-8-19(25)9-7-17/h2-14H,15H2,1H3/b22-14- |
| InChIKey |
PVMKBTFVKIEXPW-HMAPJEAMSA-N |
| Molecular Weight |
447.878 g/mol |
| SMILES |
C1(\C(C(=NN1C1=CC=C(N(=O)=O)C=C1)C)=C/C=1C(OCC2=CC=C(C=C2)Cl)=CC=CC1)=O |
![(4Z)-4-[2-(4-chlorobenzyl)oxybenzylidene]-5-methyl-2-(4-nitrophenyl)-2-pyrazolin-3-one](/api/spectrum/2vJw6SGxLDg/structure.png?h=300&w=458 "(4Z)-4-[2-(4-chlorobenzyl)oxybenzylidene]-5-methyl-2-(4-nitrophenyl)-2-pyrazolin-3-one")
