| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)c1ccc(cc1C1CCCC1)c1ncnc2cc(ccc21)OCC |
| InChI | InChI | 1.06 | InChI=1S/C22H22N2O3/c1-2-27-16-8-10-18-20(12-16)23-13-24-21(18)15-7-9-17(22(25)26)19(11-15)14-5-3-4-6-14/h7-14H,2-6H2,1H3,(H,25,26) |
| InChIKey | InChI | 1.06 | LIZGTJPPOJGDHW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCOc1ccc2c(c1)ncnc2c3ccc(C(O)=O)c(c3)C4CCCC4 |
| SMILES | CACTVS | 3.385 | CCOc1ccc2c(c1)ncnc2c3ccc(C(O)=O)c(c3)C4CCCC4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCOc1ccc2c(c1)ncnc2c3ccc(c(c3)C4CCCC4)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCOc1ccc2c(c1)ncnc2c3ccc(c(c3)C4CCCC4)C(=O)O |
