L5Q
概要
| 表記: | 5-methyl-~{N}-[2,2,2-tris(fluoranyl)ethyl]-1,2-oxazole-3-carboxamide |
| 組成式: | C7 H7 F3 N2 O2 |
| 電荷: | 0 |
| 化学式量: | 208.138 Da |
| 分子種別: | NON-POLYMER |
化合物名
| プログラム | バージョン | 表記 |
| OpenEye OEToolkits | 2.0.7 | 5-methyl-~{N}-[2,2,2-tris(fluoranyl)ethyl]-1,2-oxazole-3-carboxamide |
化合物記述子（線形表記）
| 種別 | プログラム | バージョン | 表記 |
| InChI | InChI | 1.03 | InChI=1S/C7H7F3N2O2/c1-4-2-5(12-14-4)6(13)11-3-7(8,9)10/h2H,3H2,1H3,(H,11,13) |
| InChIKey | InChI | 1.03 | XCSPVFNSKGQNKR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1onc(c1)C(=O)NCC(F)(F)F |
| SMILES | CACTVS | 3.385 | Cc1onc(c1)C(=O)NCC(F)(F)F |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc(no1)C(=O)NCC(F)(F)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(no1)C(=O)NCC(F)(F)F |
