HRID305954

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6586

Methyl chlorocarbonate

C2H3ClO2

HCID81531

Diisopropylethylamine

C8H19N

结构：COC(c1ccc(C(F)(F)F)cc1CNCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C1CCCCC1

HCID58968615

未命名化合物

PRODUCTS

生成物

结构：COC(=O)N(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Cc1cc(C(F)(F)F)ccc1C(OC)C1CCCCC1

HCID58968645

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a5fe17f3058f401f89c8d4284adf8625
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

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