| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C12H16N2O7/c13-9-11(17)10(16)8(5-15)21-12(9)20-7-3-1-6(2-4-7)14(18)19/h1-4,8-12,15-17H,5,13H2/t8-,9-,10-,11-,12-/m1/s1 |
| InChIKey | InChI | 1.03 | ZRNBGANFPXCMFT-LZQZFOIKSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1Oc2ccc(cc2)[N+]([O-])=O |
| SMILES | CACTVS | 3.385 | N[CH]1[CH](O)[CH](O)[CH](CO)O[CH]1Oc2ccc(cc2)[N+]([O-])=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1[N+](=O)[O-])O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1[N+](=O)[O-])OC2C(C(C(C(O2)CO)O)O)N |
