| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(OCC)C(Cl)c1c(cc(NC(=[N@H])N)cc1)C(=O)O |
| SMILES_CANONICAL | CACTVS | 3.341 | CCOC(=O)[C@@H](Cl)c1ccc(NC(N)=N)cc1C(O)=O |
| SMILES | CACTVS | 3.341 | CCOC(=O)[CH](Cl)c1ccc(NC(N)=N)cc1C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCOC(=O)[C@H](c1ccc(cc1C(=O)O)NC(=N)N)Cl |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCOC(=O)C(c1ccc(cc1C(=O)O)NC(=N)N)Cl |
| InChI | InChI | 1.03 | InChI=1S/C12H14ClN3O4/c1-2-20-11(19)9(13)7-4-3-6(16-12(14)15)5-8(7)10(17)18/h3-5,9H,2H2,1H3,(H,17,18)(H4,14,15,16)/t9-/m0/s1 |
| InChIKey | InChI | 1.03 | HIYFNBISGUASFH-VIFPVBQESA-N |
