| SpectraBase Spectrum ID |
1IUgmArULhW |
| Name |
Methyl 3-[4-(4-chlorobenzenesulfonylamino) butyl]-6-(2-hydroxy-1-methyl)ethylazulene-1-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H28ClNO5S |
| InChI |
InChI=1S/C25H28ClNO5S/c1-17(16-28)18-6-12-22-19(15-24(25(29)32-2)23(22)13-7-18)5-3-4-14-27-33(30,31)21-10-8-20(26)9-11-21/h6-13,15,17,27-28H,3-5,14,16H2,1-2H3 |
| InChIKey |
MJPHBSMELGVYEZ-UHFFFAOYSA-N |
| Molecular Weight |
490.014 g/mol |
| SMILES |
OCC(c1ccc2c(c(CCCCNS(c3ccc(cc3)Cl)(=O)=O)cc2C(=O)OC)cc1)C |
| SPLASH |
splash10-004i-0090000000-92850557c6327f24d790 |
| Source of Spectrum |
G2-4-582-4c |
| Wiley ID |
1661530 |
![Methyl 3-[4-(4-chlorobenzenesulfonylamino) butyl]-6-(2-hydroxy-1-methyl)ethylazulene-1-carboxylate](/api/spectrum/1IUgmArULhW/structure.png?h=300&w=458 "Methyl 3-[4-(4-chlorobenzenesulfonylamino) butyl]-6-(2-hydroxy-1-methyl)ethylazulene-1-carboxylate")
