| SpectraBase Spectrum ID |
4ciHYTaffoK |
| Name |
Benzoic acid, 2-[[[[[4-chloro-6-(2-chlorophenoxy)-1,3,5-triazin-2-yl]amino]carbonyl]amino]sulfonyl]-, methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
496.996359727 u |
| Formula |
C18H13Cl2N5O6S |
| InChI |
InChI=1S/C18H13Cl2N5O6S/c1-30-14(26)10-6-2-5-9-13(10)32(28,29)25-17(27)23-16-21-15(20)22-18(24-16)31-12-8-4-3-7-11(12)19/h2-9H,1H3,(H2,21,22,23,24,25,27) |
| InChIKey |
DXHMKYXJYZHMBA-UHFFFAOYSA-N |
| Molecular Weight |
498.297 g/mol |
| SMILES |
N(C=1N=C(N=C(N1)OC1=CC=CC=C1Cl)Cl)C(NS(=O)(=O)C1=CC=CC=C1C(OC)=O)=O |
![Benzoic acid, 2-[[[[[4-chloro-6-(2-chlorophenoxy)-1,3,5-triazin-2-yl]amino]carbonyl]amino]sulfonyl]-, methyl ester](/api/spectrum/4ciHYTaffoK/structure.png?h=300&w=458 "Benzoic acid, 2-[[[[[4-chloro-6-(2-chlorophenoxy)-1,3,5-triazin-2-yl]amino]carbonyl]amino]sulfonyl]-, methyl ester")
