| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | [O-][N+](=O)c1cc(c(OC)cc1)Cn3c2ccccc2c(c3)CC(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C18H16N2O5/c1-25-17-7-6-14(20(23)24)8-13(17)11-19-10-12(9-18(21)22)15-4-2-3-5-16(15)19/h2-8,10H,9,11H2,1H3,(H,21,22) |
| InChIKey | InChI | 1.03 | SPKRNUOKDWWUGW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(cc1Cn2cc(CC(O)=O)c3ccccc23)[N+]([O-])=O |
| SMILES | CACTVS | 3.385 | COc1ccc(cc1Cn2cc(CC(O)=O)c3ccccc23)[N+]([O-])=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | COc1ccc(cc1Cn2cc(c3c2cccc3)CC(=O)O)[N+](=O)[O-] |
| SMILES | OpenEye OEToolkits | 1.7.6 | COc1ccc(cc1Cn2cc(c3c2cccc3)CC(=O)O)[N+](=O)[O-] |
