| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | Brc2ccc(NC(=O)NC(c1cccc(/C(=C)C)c1)(C)C)cc2 |
| InChI | InChI | 1.03 | InChI=1S/C19H21BrN2O/c1-13(2)14-6-5-7-15(12-14)19(3,4)22-18(23)21-17-10-8-16(20)9-11-17/h5-12H,1H2,2-4H3,(H2,21,22,23) |
| InChIKey | InChI | 1.03 | UILINQCNOUGMOK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=C)c1cccc(c1)C(C)(C)NC(=O)Nc2ccc(Br)cc2 |
| SMILES | CACTVS | 3.385 | CC(=C)c1cccc(c1)C(C)(C)NC(=O)Nc2ccc(Br)cc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC(=C)c1cccc(c1)C(C)(C)NC(=O)Nc2ccc(cc2)Br |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC(=C)c1cccc(c1)C(C)(C)NC(=O)Nc2ccc(cc2)Br |
