| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | [O-][N+](=O)c2cccc1cc(nc12)C(=O)Nc4ccc(/C(=N/Nc3nccn3)C)cc4 |
| SMILES_CANONICAL | CACTVS | 3.370 | CC(=N\Nc1[nH]ccn1)/c2ccc(NC(=O)c3[nH]c4c(cccc4[N+]([O-])=O)c3)cc2 |
| SMILES | CACTVS | 3.370 | CC(=NNc1[nH]ccn1)c2ccc(NC(=O)c3[nH]c4c(cccc4[N+]([O-])=O)c3)cc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C/C(=N\Nc1[nH]ccn1)/c2ccc(cc2)NC(=O)c3cc4cccc(c4[nH]3)[N+](=O)[O-] |
| SMILES | OpenEye OEToolkits | 1.7.0 | CC(=NNc1[nH]ccn1)c2ccc(cc2)NC(=O)c3cc4cccc(c4[nH]3)[N+](=O)[O-] |
| InChI | InChI | 1.03 | InChI=1S/C20H17N7O3/c1-12(25-26-20-21-9-10-22-20)13-5-7-15(8-6-13)23-19(28)16-11-14-3-2-4-17(27(29)30)18(14)24-16/h2-11,24H,1H3,(H,23,28)(H2,21,22,26)/b25-12+ |
| InChIKey | InChI | 1.03 | ZRMHKCSZOJQCBI-BRJLIKDPSA-N |
