HRID2350480

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6569

Methyl ethyl ketone

C4H8O

HCID11745

Ethyl 2-bromoisobutyrate

C6H11BrO2

HCID19660

Carbonate

CO3-2

HCID6993926

未命名化合物

结构：COc1ccc(Cl)cc1C(=O)NCc1ccc(-c2ccc(O)cc2)cc1

HCID21451953

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(C)(C)Oc1ccc(-c2ccc(CNC(=O)c3cc(Cl)ccc3OC)cc2)cc1

HCID21418525

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2c59797519784afa9355110ebaeeee45
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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