HRID148851

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6342

Acetonitrile

C2H3N

HCID6344

Dichloromethane

CH2Cl2

HCID7841

Allyl bromide

C3H5Br

HCID19660

Carbonate

CO3-2

结构：COC(=O)c1ccc2c(C3CCCCC3)c(-c3ccccc3O)[nH]c2c1

HCID11995228

Methyl 3-cyclohexyl-2-(2-hydroxyphenyl)-1H-indole-6-carboxylate

C22H23NO3

PRODUCTS

生成物

结构：C=CCOc1ccccc1-c1[nH]c2cc(C(=O)OC)ccc2c1C1CCCCC1

HCID67344085

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b71cf91dd67a49f0b262d12949309f2d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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