| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)c1nc(nc(O)c1O)Cc2cc(Br)c(OC)cc2 |
| SMILES_CANONICAL | CACTVS | 3.370 | COc1ccc(Cc2nc(O)c(O)c(n2)C(O)=O)cc1Br |
| SMILES | CACTVS | 3.370 | COc1ccc(Cc2nc(O)c(O)c(n2)C(O)=O)cc1Br |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | COc1ccc(cc1Br)Cc2nc(c(c(n2)O)O)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | COc1ccc(cc1Br)Cc2nc(c(c(n2)O)O)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C13H11BrN2O5/c1-21-8-3-2-6(4-7(8)14)5-9-15-10(13(19)20)11(17)12(18)16-9/h2-4,17H,5H2,1H3,(H,19,20)(H,15,16,18) |
| InChIKey | InChI | 1.03 | LQQYBZYFFRDXNT-UHFFFAOYSA-N |
