HRID2136287

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID75269

Acetic acid, anhydride with formic acid

C3H4O3

结构：CCOc1cc(C(CCNO)N2C(=O)c3cccc(NC(C)=O)c3C2=O)ccc1OC

HCID22387258

未命名化合物

PRODUCTS

生成物

结构：CCOc1cc(C(CCN(O)C=O)N2C(=O)c3cccc(NC(C)=O)c3C2=O)ccc1OC

HCID22387259

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-41a87686e8bd47c89f6e8e3771da8585
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][c:6]([CH:12]([CH2:13][CH2:14][NH:15][OH:16])[N:17]2[C:18](=[O:31])[c:19]3[cH:20][cH:21][cH:22][c:23]([NH:27][C:28]([CH3:29])=[O:30])[c:24]3[C:25]2=[O:26])[cH:7][cH:8][c:9]1[O:10][CH3:11].[CH2:38]([Cl:39])[Cl:40].[CH:32](=[O:33])[O:34][C:35](=[O:36])[CH3:37]>>[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][c:6]([CH:12]([CH2:13][CH2:14][N:15]([OH:16])[CH:32]=[O:33])[N:17]2[C:18](=[O:31])[c:19]3[cH:20][cH:21][cH:22][c:23]([NH:27][C:28]([CH3:29])=[O:30])[c:24]3[C:25]2=[O:26])[cH:7][cH:8][c:9]1[O:10][CH3:11]