| SpectraBase Spectrum ID |
3PQ8o3COeO6 |
| Name |
2-Propenoic acid, 3-[2-chloro-5-(1,3,4,5,6,7-hexahydro-1,3-dioxo-2H-isoindol-2-yl)phenyl]-, ethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
359.092435760 u |
| Formula |
C19H18ClNO4 |
| InChI |
InChI=1S/C19H18ClNO4/c1-2-25-17(22)10-7-12-11-13(8-9-16(12)20)21-18(23)14-5-3-4-6-15(14)19(21)24/h7-11H,2-6H2,1H3/b10-7+ |
| InChIKey |
NYNRGROEYQOAOB-JXMROGBWSA-N |
| Molecular Weight |
359.809 g/mol |
| SMILES |
C1(N(C(C=2CCCCC12)=O)C1=CC(=C(C=C1)Cl)\C=C\C(OCC)=O)=O |
![2-Propenoic acid, 3-[2-chloro-5-(1,3,4,5,6,7-hexahydro-1,3-dioxo-2H-isoindol-2-yl)phenyl]-, ethyl ester](/api/spectrum/3PQ8o3COeO6/structure.png?h=300&w=458 "2-Propenoic acid, 3-[2-chloro-5-(1,3,4,5,6,7-hexahydro-1,3-dioxo-2H-isoindol-2-yl)phenyl]-, ethyl ester")
