HRID301684

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6371

Phosgene

CCl2O

HCID7504

Benzylamine

C7H9N

HCID8471

Triethylamine

C6H15N

HCID81531

Diisopropylethylamine

C8H19N

结构：CCNCc1cc(C(F)(F)F)ccc1-c1cc(CC(=O)OC)ccc1OC

HCID66603748

未命名化合物

PRODUCTS

生成物

结构：CCN(Cc1cc(C(F)(F)F)ccc1-c1cc(CC(=O)OC)ccc1OC)C(=O)NCc1ccccc1

HCID66604003

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3edd9db6254b412cabfd5739908b5d71
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][c:7](-[c:13]2[c:14]([CH2:23][NH:24][CH2:25][CH3:26])[cH:15][c:16]([C:19]([F:20])([F:21])[F:22])[cH:17][cH:18]2)[c:8]([O:11][CH3:12])[cH:9][cH:10]1)=[O:27].[CH3:49][CH2:50][N:51]([CH2:52][CH3:53])[CH2:54][CH3:55].[CH:28]([N:29]([CH:30]([CH3:31])[CH3:32])[CH2:33][CH3:34])([CH3:35])[CH3:36].[Cl:37][C:38]([Cl:39])=[O:40].[Cl:56][CH2:57][Cl:58].[NH2:41][CH2:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1>>[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][c:7](-[c:13]2[c:14]([CH2:23][N:24]([CH2:25][CH3:26])[C:38](=[O:40])[NH:41][CH2:42][c:43]3[cH:44][cH:45][cH:46][cH:47][cH:48]3)[cH:15][c:16]([C:19]([F:20])([F:21])[F:22])[cH:17][cH:18]2)[c:8]([O:11][CH3:12])[cH:9][cH:10]1)=[O:27]