| 種別 | プログラム | バージョン | 表記 |
| InChI | InChI | 1.03 | InChI=1S/C22H23NO3/c1-3-26-21-12-8-7-11-18(21)23-15(2)22-19(24)13-17(14-20(22)25)16-9-5-4-6-10-16/h4-12,17,24H,3,13-14H2,1-2H3/b23-15+/t17-/m0/s1 |
| InChIKey | InChI | 1.03 | SXTKBCIYVZKDSS-BDFKGGEMSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCOc1ccccc1N=C(C)C2=C(O)C[C@@H](CC2=O)c3ccccc3 |
| SMILES | CACTVS | 3.385 | CCOc1ccccc1N=C(C)C2=C(O)C[CH](CC2=O)c3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCOc1ccccc1/N=C(\C)/C2=C(C[C@@H](CC2=O)c3ccccc3)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | CCOc1ccccc1N=C(C)C2=C(CC(CC2=O)c3ccccc3)O |
