| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | Fc1ccc(cc1)C4CCNCC4COc3cc2C=NC(=O)c2cc3 |
| InChI | InChI | 1.03 | InChI=1S/C20H19FN2O2/c21-16-3-1-13(2-4-16)18-7-8-22-10-15(18)12-25-17-5-6-19-14(9-17)11-23-20(19)24/h1-6,9,11,15,18,22H,7-8,10,12H2/t15-,18-/m0/s1 |
| InChIKey | InChI | 1.03 | SVALMNHLKNCREX-YJBOKZPZSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Fc1ccc(cc1)[C@@H]2CCNC[C@H]2COc3ccc4C(=O)N=Cc4c3 |
| SMILES | CACTVS | 3.385 | Fc1ccc(cc1)[CH]2CCNC[CH]2COc3ccc4C(=O)N=Cc4c3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(ccc1[C@@H]2CCNC[C@H]2COc3ccc4c(c3)C=NC4=O)F |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(ccc1C2CCNCC2COc3ccc4c(c3)C=NC4=O)F |
