| SpectraBase Spectrum ID |
Jjfmv0ZtuRU |
| Name |
1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-3-methyl-7-(phenylmethyl)purine-2,6-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H17ClN4O4 |
| InChI |
InChI=1S/C21H17ClN4O4/c1-24-19-18(25(11-23-19)9-13-5-3-2-4-6-13)20(27)26(21(24)28)10-14-7-16-17(8-15(14)22)30-12-29-16/h2-8,11H,9-10,12H2,1H3 |
| InChIKey |
UWJGCJVTGIJMTK-UHFFFAOYSA-N |
| Molecular Weight |
424.844 g/mol |
| SMILES |
c1ccc(C[n]2c3c(nc2)N(C(N(C3=O)Cc2c(cc3c(c2)OCO3)Cl)=O)C)cc1 |
| SPLASH |
splash10-000l-7509000000-22075d4c1160af501df9 |
| Synonyms |
1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-methyl-7-(phenylmethyl)purine-2,6-dione
7-Benzyl-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
7-Benzyl-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-methyl-purine-2,6-dione
7-Benzyl-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-methyl-xanthine |
| Wiley ID |
1460102 |
![1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-3-methyl-7-(phenylmethyl)purine-2,6-dione](/api/spectrum/Jjfmv0ZtuRU/structure.png?h=300&w=458 "1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-3-methyl-7-(phenylmethyl)purine-2,6-dione")
