| SpectraBase Spectrum ID |
f24PdZkj7P |
| Name |
6-(2-Hydroxy-3-(4-(pyridin-2-yl)piperazin-1-yl)propoxy)-2-methyl-9H-xanthen-9-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
445.200156357 u |
| Formula |
C26H27N3O4 |
| InChI |
InChI=1S/C26H27N3O4/c1-18-5-8-23-22(14-18)26(31)21-7-6-20(15-24(21)33-23)32-17-19(30)16-28-10-12-29(13-11-28)25-4-2-3-9-27-25/h2-9,14-15,19,30H,10-13,16-17H2,1H3 |
| InChIKey |
WOVDDTOIJFECNO-UHFFFAOYSA-N |
| Molecular Weight |
445.519 g/mol |
| SMILES |
C1(C=2C=C(C=CC2OC=2C=C(C=CC12)OCC(CN1CCN(CC1)C=1C=CC=CN1)O)C)=O |
