H0G
概要
| 表記: | 2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide |
| 組成式: | C12 H12 N2 O2 |
| 電荷: | 0 |
| 化学式量: | 216.236 Da |
| 分子種別: | NON-POLYMER |
化合物名
| プログラム | バージョン | 表記 |
| ACDLabs | 12.01 | 2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide |
| OpenEye OEToolkits | 2.0.6 | 2-(3-methylphenyl)-~{N}-(1,2-oxazol-3-yl)ethanamide |
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 | 12.01 | N(C(Cc1cccc(C)c1)=O)c2ccon2 |
| InChI | InChI | 1.03 | InChI=1S/C12H12N2O2/c1-9-3-2-4-10(7-9)8-12(15)13-11-5-6-16-14-11/h2-7H,8H2,1H3,(H,13,14,15) |
| InChIKey | InChI | 1.03 | AFEIJLUSZUKBHP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cccc(CC(=O)Nc2ccon2)c1 |
| SMILES | CACTVS | 3.385 | Cc1cccc(CC(=O)Nc2ccon2)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1cccc(c1)CC(=O)Nc2ccon2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1cccc(c1)CC(=O)Nc2ccon2 |
