| SpectraBase Spectrum ID |
qcSwaj3A4h |
| Name |
N-(1,3-Benzodioxol-5-ylmethyl)-3-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)propanamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
402.121571683 u |
| Formula |
C23H18N2O5 |
| InChI |
InChI=1S/C23H18N2O5/c26-20(24-12-14-7-8-18-19(11-14)30-13-29-18)9-10-25-22(27)16-5-1-3-15-4-2-6-17(21(15)16)23(25)28/h1-8,11H,9-10,12-13H2,(H,24,26) |
| InChIKey |
SICHMCIRSVCDKR-UHFFFAOYSA-N |
| Molecular Weight |
402.406 g/mol |
| SMILES |
N(C(CCN1C(C2=CC=CC=3C2=C(C1=O)C=CC3)=O)=O)CC1=CC=2OCOC2C=C1 |
![N-(1,3-benzodioxol-5-ylmethyl)-3-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)propanamide](/api/spectrum/qcSwaj3A4h/structure.png?h=300&w=458 "N-(1,3-benzodioxol-5-ylmethyl)-3-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)propanamide")
