| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)c1nc(nc(O)c1O)Cc3c2ccccc2nc3c4ccccc4 |
| SMILES_CANONICAL | CACTVS | 3.370 | OC(=O)c1nc(Cc2c([nH]c3ccccc23)c4ccccc4)nc(O)c1O |
| SMILES | CACTVS | 3.370 | OC(=O)c1nc(Cc2c([nH]c3ccccc23)c4ccccc4)nc(O)c1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)c2c(c3ccccc3[nH]2)Cc4nc(c(c(n4)O)O)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)c2c(c3ccccc3[nH]2)Cc4nc(c(c(n4)O)O)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C20H15N3O4/c24-18-17(20(26)27)22-15(23-19(18)25)10-13-12-8-4-5-9-14(12)21-16(13)11-6-2-1-3-7-11/h1-9,21,24H,10H2,(H,26,27)(H,22,23,25) |
| InChIKey | InChI | 1.03 | JONQCFJPPWOWOJ-UHFFFAOYSA-N |
