P83
概要
| 表記: | 1-(9-ethyl-9H-carbazol-3-yl)-N-methylmethanamine |
| 組成式: | C16 H18 N2 |
| 電荷: | 0 |
| 化学式量: | 238.328 Da |
| 分子種別: | non-polymer |
化合物名
| プログラム | バージョン | 表記 |
| ACDLabs | 10.04 | 1-(9-ethyl-9H-carbazol-3-yl)-N-methylmethanamine |
| OpenEye OEToolkits | 1.5.0 | 1-(9-ethylcarbazol-3-yl)-N-methyl-methanamine |
化合物記述子（線形表記）
| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 10.04 | c1cccc3c1c2c(ccc(c2)CNC)n3CC |
| SMILES_CANONICAL | CACTVS | 3.341 | CCn1c2ccccc2c3cc(CNC)ccc13 |
| SMILES | CACTVS | 3.341 | CCn1c2ccccc2c3cc(CNC)ccc13 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCn1c2ccccc2c3c1ccc(c3)CNC |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCn1c2ccccc2c3c1ccc(c3)CNC |
| InChI | InChI | 1.03 | InChI=1S/C16H18N2/c1-3-18-15-7-5-4-6-13(15)14-10-12(11-17-2)8-9-16(14)18/h4-10,17H,3,11H2,1-2H3 |
| InChIKey | InChI | 1.03 | LBPNOEAFWYTTEB-UHFFFAOYSA-N |
