| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(c2nc(c1ccccc1)nc2C(=O)O)N3CCOCC3 |
| SMILES_CANONICAL | CACTVS | 3.352 | OC(=O)c1[nH]c(nc1C(=O)N2CCOCC2)c3ccccc3 |
| SMILES | CACTVS | 3.352 | OC(=O)c1[nH]c(nc1C(=O)N2CCOCC2)c3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | c1ccc(cc1)c2[nH]c(c(n2)C(=O)N3CCOCC3)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.6.1 | c1ccc(cc1)c2[nH]c(c(n2)C(=O)N3CCOCC3)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C15H15N3O4/c19-14(18-6-8-22-9-7-18)11-12(15(20)21)17-13(16-11)10-4-2-1-3-5-10/h1-5H,6-9H2,(H,16,17)(H,20,21) |
| InChIKey | InChI | 1.03 | VLPLWGMKNLKROX-UHFFFAOYSA-N |
