| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(O)c1ccccc1Nc1cccc(c1C)[N+]([O-])=O |
| InChI | InChI | 1.06 | InChI=1S/C14H12N2O4/c1-9-11(7-4-8-13(9)16(19)20)15-12-6-3-2-5-10(12)14(17)18/h2-8,15H,1H3,(H,17,18) |
| InChIKey | InChI | 1.06 | HDSHJLYBOCCRCF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1c(Nc2ccccc2C(O)=O)cccc1[N+]([O-])=O |
| SMILES | CACTVS | 3.385 | Cc1c(Nc2ccccc2C(O)=O)cccc1[N+]([O-])=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | Cc1c(cccc1[N+](=O)[O-])Nc2ccccc2C(=O)O |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | Cc1c(cccc1[N+](=O)[O-])Nc2ccccc2C(=O)O |
