| SpectraBase Spectrum ID |
7lpr5BOzveo |
| Name |
7-(3,4-Dichlorobenzyl)-8-[(4-methoxybenzyl)oxy]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
474.086160536 u |
| Formula |
C22H20Cl2N4O4 |
| InChI |
InChI=1S/C22H20Cl2N4O4/c1-26-19-18(20(29)27(2)22(26)30)28(11-14-6-9-16(23)17(24)10-14)21(25-19)32-12-13-4-7-15(31-3)8-5-13/h4-10H,11-12H2,1-3H3 |
| InChIKey |
QXSQAOMZAWYXLS-UHFFFAOYSA-N |
| Molecular Weight |
475.332 g/mol |
| SMILES |
C12=C(N(CC=3C=C(Cl)C(=CC3)Cl)C(=N1)OCC1=CC=C(C=C1)OC)C(=O)N(C(N2C)=O)C |
![7-(3,4-dichlorobenzyl)-8-[(4-methoxybenzyl)oxy]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione](/api/spectrum/7lpr5BOzveo/structure.png?h=300&w=458 "7-(3,4-dichlorobenzyl)-8-[(4-methoxybenzyl)oxy]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione")
