| SpectraBase Spectrum ID |
IzHXLw55xJ8 |
| Name |
Ethyl 3-acetoxy-3-[4-bromo-1-(toluene-4-sulfonyl)-1H-indol-3-yl]propionate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H22BrNO6S |
| InChI |
InChI=1S/C22H22BrNO6S/c1-4-29-21(26)12-20(30-15(3)25)17-13-24(19-7-5-6-18(23)22(17)19)31(27,28)16-10-8-14(2)9-11-16/h5-11,13,20H,4,12H2,1-3H3 |
| InChIKey |
WDCYQBMYQDUSLY-UHFFFAOYSA-N |
| Molecular Weight |
508.383 g/mol |
| SMILES |
C(CC(c1c[n](c2c1c(ccc2)Br)S(=O)(=O)c1ccc(cc1)C)OC(=O)C)(=O)OCC |
| SPLASH |
splash10-0006-9000000000-1f50bb404fa85ecf90f8 |
| Source of Spectrum |
O1-56-528-6 |
| Synonyms |
ethyl 3-(acetyloxy)-3-{4-bromo-1-[(4-methylphenyl)sulfonyl]-1H-indol-3-yl}propanoate |
| Wiley ID |
1591689 |
![Ethyl 3-acetoxy-3-[4-bromo-1-(toluene-4-sulfonyl)-1H-indol-3-yl]propionate](/api/spectrum/IzHXLw55xJ8/structure.png?h=300&w=458 "Ethyl 3-acetoxy-3-[4-bromo-1-(toluene-4-sulfonyl)-1H-indol-3-yl]propionate")
