| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | O=C(N1CCN(CC1)C(=O)Nc1cc(C)ccc1OC)c1ccco1 |
| InChI | InChI | 1.06 | InChI=1S/C18H21N3O4/c1-13-5-6-15(24-2)14(12-13)19-18(23)21-9-7-20(8-10-21)17(22)16-4-3-11-25-16/h3-6,11-12H,7-10H2,1-2H3,(H,19,23) |
| InChIKey | InChI | 1.06 | SUWVNQBVHZNJOQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(C)cc1NC(=O)N2CCN(CC2)C(=O)c3occc3 |
| SMILES | CACTVS | 3.385 | COc1ccc(C)cc1NC(=O)N2CCN(CC2)C(=O)c3occc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1ccc(c(c1)NC(=O)N2CCN(CC2)C(=O)c3ccco3)OC |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccc(c(c1)NC(=O)N2CCN(CC2)C(=O)c3ccco3)OC |
