| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | OCC2[n+]1cc(nc1C(O)C(O)C2O)CNc3ccccc3 |
| SMILES_CANONICAL | CACTVS | 3.341 | OC[C@@H]1[C@@H](O)[C@H](O)[C@H](O)c2[nH]c(CNc3ccccc3)c[n+]12 |
| SMILES | CACTVS | 3.341 | OC[CH]1[CH](O)[CH](O)[CH](O)c2[nH]c(CNc3ccccc3)c[n+]12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)NCc2c[n+]3c([nH]2)[C@H]([C@H]([C@@H]([C@H]3CO)O)O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)NCc2c[n+]3c([nH]2)C(C(C(C3CO)O)O)O |
| InChI | InChI | 1.03 | InChI=1S/C15H19N3O4/c19-8-11-12(20)13(21)14(22)15-17-10(7-18(11)15)6-16-9-4-2-1-3-5-9/h1-5,7,11-14,16,19-22H,6,8H2/p+1/t11-,12-,13+,14+/m1/s1 |
| InChIKey | InChI | 1.03 | ADKWVGPRAQKVKB-MQYQWHSLSA-O |
