| SpectraBase Spectrum ID |
AK6Oza38mAn |
| Name |
1-[3-(3,5-Dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]-4-(4-methoxybenzoyl)piperazine |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
435.190654301 u |
| Formula |
C23H25N5O4 |
| InChI |
InChI=1S/C23H25N5O4/c1-16-14-17(2)27(24-16)22-15-19(6-9-21(22)28(30)31)25-10-12-26(13-11-25)23(29)18-4-7-20(32-3)8-5-18/h4-9,14-15H,10-13H2,1-3H3 |
| InChIKey |
UZIHABIJZKNLSJ-UHFFFAOYSA-N |
| Molecular Weight |
435.484 g/mol |
| SMILES |
COC=1C=CC(C(N2CCN(C=3C=C(N4N=C(C)C=C4C)C(N(=O)=O)=CC3)CC2)=O)=CC1 |
![1-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]-4-(4-methoxybenzoyl)piperazine](/api/spectrum/AK6Oza38mAn/structure.png?h=300&w=458 "1-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]-4-(4-methoxybenzoyl)piperazine")
