| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | OC2C(c1ccc(N)c(N)c1)NC(CO)C2O |
| SMILES_CANONICAL | CACTVS | 3.341 | Nc1ccc(cc1N)[C@@H]2N[C@H](CO)[C@@H](O)[C@H]2O |
| SMILES | CACTVS | 3.341 | Nc1ccc(cc1N)[CH]2N[CH](CO)[CH](O)[CH]2O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1[C@H]2[C@@H]([C@@H]([C@H](N2)CO)O)O)N)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1C2C(C(C(N2)CO)O)O)N)N |
| InChI | InChI | 1.03 | InChI=1S/C11H17N3O3/c12-6-2-1-5(3-7(6)13)9-11(17)10(16)8(4-15)14-9/h1-3,8-11,14-17H,4,12-13H2/t8-,9+,10-,11+/m1/s1 |
| InChIKey | InChI | 1.03 | YAYMFJWCRXEXGZ-YTWAJWBKSA-N |
