HRID114257

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID6344

Dichloromethane

CH2Cl2

HCID11915

Phenylglyoxylic acid

C8H6O3

结构：FC(F)(F)c1ccc(CCNc2ccc(C(F)(F)F)nc2)cc1

HCID58007513

未命名化合物

PRODUCTS

生成物

结构：O=C(C(=O)N(CCc1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)nc1)c1ccccc1

HCID58007548

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-dd85f1ff55404994a9b6766ba9774137
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[C:24]([c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)(=[O:31])[C:32](=[O:33])[OH:34].[CH2:35]([Cl:36])[CH2:37][Cl:38].[Cl:39][CH2:40][Cl:41].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([CH2:9][CH2:10][NH:11][c:12]2[cH:13][n:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][cH:17]2)[cH:7][cH:8]1)([F:22])[F:23]>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([CH2:9][CH2:10][N:11]([c:12]2[cH:13][n:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][cH:17]2)[C:32]([C:24]([c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)=[O:31])=[O:33])[cH:7][cH:8]1)([F:22])[F:23]