FSZ
概要
| 表記: | 1-[3-piperidin-4-yl-5-(trifluoromethyl)phenyl]guanidine |
| 組成式: | C13 H17 F3 N4 |
| 電荷: | 0 |
| 化学式量: | 286.296 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 | 2.0.6 | 1-[3-piperidin-4-yl-5-(trifluoromethyl)phenyl]guanidine |
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/C13H17F3N4/c14-13(15,16)10-5-9(8-1-3-19-4-2-8)6-11(7-10)20-12(17)18/h5-8,19H,1-4H2,(H4,17,18,20) |
| InChIKey | InChI | 1.03 | SVJLJEMEWHBCNB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=N)Nc1cc(cc(c1)C(F)(F)F)C2CCNCC2 |
| SMILES | CACTVS | 3.385 | NC(=N)Nc1cc(cc(c1)C(F)(F)F)C2CCNCC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | [H]/N=C(/N)\Nc1cc(cc(c1)C(F)(F)F)C2CCNCC2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1c(cc(cc1C(F)(F)F)NC(=N)N)C2CCNCC2 |
