HRID695518

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID8857

Ethyl acetate

C4H8O2

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID181552

Benzeneacetyl chloride, 4-bromo-

C8H6BrClO

HCID598182

2-bromo-2-phenylacetyl chloride

C8H6BrClO

HCID13467414

未命名化合物

PRODUCTS

生成物

结构：COc1cccc(CCN(C(=O)Cc2ccc(Br)cc2)c2ccccc2)c1

HCID23440798

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-32f170ceeb594f229873c222c07802c1
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[Br:18][c:19]1[cH:20][cH:21][c:22]([CH2:25][C:26](=[O:27])[Cl:28])[cH:23][cH:24]1.[Br:29][CH:30]([c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1)[C:37]([Cl:38])=[O:39].[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:9][CH2:10][NH:11][c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:6][cH:7][cH:8]1.[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[Cl:40][C:41]([C:42]([Cl:43])=[O:44])=[O:45].[Cl:52][CH2:53][Cl:54].[OH2:55]>>[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:9][CH2:10][N:11]([c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[C:26]([CH2:25][c:22]2[cH:21][cH:20][c:19]([Br:18])[cH:24][cH:23]2)=[O:27])[cH:6][cH:7][cH:8]1