HRID119315

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID6342

Acetonitrile

C2H3N

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID15233463

4-(3-Bromopropoxy)-1,1'-biphenyl

C15H15BrO

HCID58822986

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(Cc1ccc(OCCCOc2ccc(-c3ccccc3)cc2)c(OC)c1)OC

HCID58822669

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c361888856f2405e9f90eea991efd646
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

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