HRID1560771

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID57456272

1,1-Dimethylethyl N-(2-amino-4-chlorophenyl)carbamate

C11H15ClN2O2

结构：Cc1ccc(-c2cccc(C(=O)CC(=O)OC(C)(C)C)c2)cn1

HCID69489386

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(-c2cccc(C(=O)CC(=O)Nc3cc(Cl)ccc3NC(=O)OC(C)(C)C)c2)cn1

HCID86589245

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fee0d527cade49b48c5d2ef3f70d1224
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[C:17]([CH3:19])([CH3:20])([O:21][C:22](=[O:18])[CH2:23][C:24](=[O:25])[c:26]1[cH:27][c:28](-[c:32]2[cH:33][n:34][c:35]([CH3:38])[cH:36][cH:37]2)[cH:29][cH:30][cH:31]1)[CH3:39].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([NH2:15])[cH:10][c:11]([Cl:14])[cH:12][cH:13]1)=[O:16]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([NH:15][C:22](=[O:21])[CH2:23][C:24](=[O:25])[c:26]2[cH:27][c:28](-[c:32]3[cH:33][n:34][c:35]([CH3:38])[cH:36][cH:37]3)[cH:29][cH:30][cH:31]2)[cH:10][c:11]([Cl:14])[cH:12][cH:13]1)=[O:16]