| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C12H21N3O4/c1-7(16)14-2-4-15(5-3-14)10-11(17)9(13)8-6-18-12(10)19-8/h8-12,17H,2-6,13H2,1H3/t8-,9-,10-,11?,12-/m1/s1 |
| InChIKey | InChI | 1.06 | SMKPDPYRSRUSLD-JIPOKYKOSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)N1CCN(CC1)[C@@H]2[C@@H](O)[C@H](N)[C@H]3CO[C@@H]2O3 |
| SMILES | CACTVS | 3.385 | CC(=O)N1CCN(CC1)[CH]2[CH](O)[CH](N)[CH]3CO[CH]2O3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)N1CCN(CC1)[C@@H]2[C@H]([C@@H]([C@H]3CO[C@@H]2O3)N)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)N1CCN(CC1)C2C(C(C3COC2O3)N)O |
