CVO
概要
| 表記: | piperidin-4-ylmethyl 4-(aminomethyl)-4-fluoranyl-piperidine-1-carboxylate |
| 組成式: | C13 H24 F N3 O2 |
| 電荷: | 0 |
| 化学式量: | 273.347 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 | piperidin-4-ylmethyl 4-(aminomethyl)-4-fluoranyl-piperidine-1-carboxylate |
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/C13H24FN3O2/c14-13(10-15)3-7-17(8-4-13)12(18)19-9-11-1-5-16-6-2-11/h11,16H,1-10,15H2 |
| InChIKey | InChI | 1.03 | DOWIQGRBTWGHLC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NCC1(F)CCN(CC1)C(=O)OCC2CCNCC2 |
| SMILES | CACTVS | 3.385 | NCC1(F)CCN(CC1)C(=O)OCC2CCNCC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C1CNCCC1COC(=O)N2CCC(CC2)(CN)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | C1CNCCC1COC(=O)N2CCC(CC2)(CN)F |
