| SpectraBase Spectrum ID |
EBDG3vOwuOD |
| Name |
4-Pyrrol4-[6-(1,3-dioxo-1,3-dihydro-isoindol-2-yl)-hexyl]-piperazin-1-ylmorpho-benzonitrile |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
416.221226156 u |
| Formula |
C25H28N4O2 |
| InChI |
InChI=1S/C25H28N4O2/c26-19-20-9-11-21(12-10-20)28-17-15-27(16-18-28)13-5-1-2-6-14-29-24(30)22-7-3-4-8-23(22)25(29)31/h3-4,7-12H,1-2,5-6,13-18H2 |
| InChIKey |
YPYDNRMILNEYJN-UHFFFAOYSA-N |
| Molecular Weight |
416.525 g/mol |
| SMILES |
C(CCCCCN1C(C2=CC=CC=C2C1=O)=O)N1CCN(CC1)C1=CC=C(C=C1)C#N |
![4-Pyrrol4-[6-(1,3-dioxo-1,3-dihydro-isoindol-2-yl)-hexyl]-piperazin-1-ylmorpho-benzonitrile](/api/spectrum/EBDG3vOwuOD/structure.png?h=300&w=458 "4-Pyrrol4-[6-(1,3-dioxo-1,3-dihydro-isoindol-2-yl)-hexyl]-piperazin-1-ylmorpho-benzonitrile")
