EXN
概要
| 表記: | [9-ethyl-7-(furan-2-yl)carbazol-3-yl]methyl-methyl-azanium |
| 組成式: | C20 H21 N2 O |
| 電荷: | 1 |
| 化学式量: | 305.394 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 | [9-ethyl-7-(furan-2-yl)carbazol-3-yl]methyl-methyl-azanium |
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/C20H20N2O/c1-3-22-18-9-6-14(13-21-2)11-17(18)16-8-7-15(12-19(16)22)20-5-4-10-23-20/h4-12,21H,3,13H2,1-2H3/p+1 |
| InChIKey | InChI | 1.03 | UTFNBBWDJPFLJT-UHFFFAOYSA-O |
| SMILES_CANONICAL | CACTVS | 3.385 | CCn1c2ccc(C[NH2+]C)cc2c3ccc(cc13)c4occc4 |
| SMILES | CACTVS | 3.385 | CCn1c2ccc(C[NH2+]C)cc2c3ccc(cc13)c4occc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCn1c2ccc(cc2c3c1cc(cc3)c4ccco4)C[NH2+]C |
| SMILES | OpenEye OEToolkits | 2.0.6 | CCn1c2ccc(cc2c3c1cc(cc3)c4ccco4)C[NH2+]C |
