| SpectraBase Spectrum ID |
INJUDAftcfX |
| Name |
2,5-Pyrrolidinedione, 3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-(4-chlorophenyl)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
427.129883896 u |
| Formula |
C22H22ClN3O4 |
| InChI |
InChI=1S/C22H22ClN3O4/c23-16-2-4-17(5-3-16)26-21(27)12-18(22(26)28)25-9-7-24(8-10-25)13-15-1-6-19-20(11-15)30-14-29-19/h1-6,11,18H,7-10,12-14H2 |
| InChIKey |
NPPXRFMWYOCJIN-UHFFFAOYSA-N |
| Molecular Weight |
427.888 g/mol |
| SMILES |
C=1C(Cl)=CC=C(N2C(C(N3CCN(CC3)CC3=CC=4OCOC4C=C3)CC2=O)=O)C1 |
![2,5-Pyrrolidinedione, 3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-(4-chlorophenyl)-](/api/spectrum/INJUDAftcfX/structure.png?h=300&w=458 "2,5-Pyrrolidinedione, 3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-(4-chlorophenyl)-")
