| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | [O-][N+](=O)c1c3c(c(cc1)Nc2cc(ccc2)C(=O)O)cccc3 |
| InChI | InChI | 1.03 | InChI=1S/C17H12N2O4/c20-17(21)11-4-3-5-12(10-11)18-15-8-9-16(19(22)23)14-7-2-1-6-13(14)15/h1-10,18H,(H,20,21) |
| InChIKey | InChI | 1.03 | ZLIDMWNTWSBTSM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | OC(=O)c1cccc(Nc2ccc(c3ccccc23)[N+]([O-])=O)c1 |
| SMILES | CACTVS | 3.370 | OC(=O)c1cccc(Nc2ccc(c3ccccc23)[N+]([O-])=O)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc2c(c1)c(ccc2[N+](=O)[O-])Nc3cccc(c3)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc2c(c1)c(ccc2[N+](=O)[O-])Nc3cccc(c3)C(=O)O |
