| SpectraBase Spectrum ID |
HFqwHLlDqfS |
| Name |
N-[3-(N-(2,2-Dichloro-1-oxoethyl)-4-nitroanilino)propyl]-3-methoxybenzamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
439.070176119 u |
| Formula |
C19H19Cl2N3O5 |
| InChI |
InChI=1S/C19H19Cl2N3O5/c1-29-16-5-2-4-13(12-16)18(25)22-10-3-11-23(19(26)17(20)21)14-6-8-15(9-7-14)24(27)28/h2,4-9,12,17H,3,10-11H2,1H3,(H,22,25) |
| InChIKey |
ZQQIIBMLQVOELL-UHFFFAOYSA-N |
| Molecular Weight |
440.283 g/mol |
| SMILES |
C(CNC(=O)C1=CC(=CC=C1)OC)CN(C(=O)C(Cl)Cl)C1=CC=C(C=C1)N(=O)=O |
![N-[3-(N-(2,2-dichloro-1-oxoethyl)-4-nitroanilino)propyl]-3-methoxybenzamide](/api/spectrum/HFqwHLlDqfS/structure.png?h=300&w=458 "N-[3-(N-(2,2-dichloro-1-oxoethyl)-4-nitroanilino)propyl]-3-methoxybenzamide")
