HRID678081

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID13387

N-Methyl-2-pyrrolidone

C5H9NO

HCID19660

Carbonate

CO3-2

HCID117640

tert-Butyl 4-hydroxybenzoate

C11H14O3

HCID67080208

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C1CCOc2cc(Oc3ccc(C(=O)OC(C)(C)C)cc3)c(C#N)cc21

HCID67080240

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4227cd0cd3a04f169b698fba72bb1995
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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