| SpectraBase Spectrum ID |
JeYE914sdQC |
| Name |
Ethyl 3-{[3'-(1'',3''-dioxo-1'',3''-dihydro-2H-isoindol-2''-yl)-5'-phenylpentanoyl]amino}-propanoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
422.184171940 u |
| Formula |
C24H26N2O5 |
| InChI |
InChI=1S/C24H26N2O5/c1-2-31-22(28)14-15-25-21(27)16-18(13-12-17-8-4-3-5-9-17)26-23(29)19-10-6-7-11-20(19)24(26)30/h3-11,18H,2,12-16H2,1H3,(H,25,27) |
| InChIKey |
GODGPHUBVCSIMM-UHFFFAOYSA-N |
| Molecular Weight |
422.481 g/mol |
| SMILES |
C1(N(C(C=2C=CC=CC12)=O)C(CC(=O)NCCC(=O)OCC)CCC1=CC=CC=C1)=O |
![Ethyl 3-{[3'-(1'',3''-dioxo-1'',3''-dihydro-2H-isoindol-2''-yl)-5'-phenylpentanoyl]amino}-propanoate](/api/spectrum/JeYE914sdQC/structure.png?h=300&w=458 "Ethyl 3-{[3'-(1'',3''-dioxo-1'',3''-dihydro-2H-isoindol-2''-yl)-5'-phenylpentanoyl]amino}-propanoate")
