| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | [O-][N+](=O)c1cc(c(O)c(O)c1)C(=O)NC/C=C/C3OC(N2C=CC(=O)C=C2)C(O)C3O |
| SMILES_CANONICAL | CACTVS | 3.370 | O[C@H]1[C@@H](O)[C@@H](O[C@@H]1\C=C\CNC(=O)c2cc(cc(O)c2O)[N+]([O-])=O)N3C=CC(=O)C=C3 |
| SMILES | CACTVS | 3.370 | O[CH]1[CH](O)[CH](O[CH]1C=CCNC(=O)c2cc(cc(O)c2O)[N+]([O-])=O)N3C=CC(=O)C=C3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1c(cc(c(c1C(=O)NC/C=C/[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=CC(=O)C=C3)O)O)O)O)[N+](=O)[O-] |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1c(cc(c(c1C(=O)NCC=CC2C(C(C(O2)N3C=CC(=O)C=C3)O)O)O)O)[N+](=O)[O-] |
| InChI | InChI | 1.03 | InChI=1S/C19H19N3O9/c23-11-3-6-21(7-4-11)19-17(27)16(26)14(31-19)2-1-5-20-18(28)12-8-10(22(29)30)9-13(24)15(12)25/h1-4,6-9,14,16-17,19,24-27H,5H2,(H,20,28)/b2-1+/t14-,16-,17-,19-/m1/s1 |
| InChIKey | InChI | 1.03 | HVTOTCCLXQPREB-LDNIWRHMSA-N |
