HRID1216185

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID85582

1H-Imidazole, 2-undecyl-

C14H26N2

结构：COc1ccccc1OCCCc1oc(Cl)nc1-c1ccc(Cl)cc1

HCID10959800

未命名化合物

PRODUCTS

生成物

结构：CCCCCCCCCCCc1nccn1-c1nc(-c2ccc(Cl)cc2)c(CCCOc2ccccc2OC)o1

HCID18174719

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7081473637674ea4b0f619a984b46315
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[C:42](=[O:43])([O-:44])[O-:45].[CH2:26]([CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH3:36])[c:37]1[nH:38][cH:39][cH:40][n:41]1.[CH3:48][N:49]([CH3:50])[CH:51]=[O:52].[Cl:1][c:2]1[o:3][c:4]([CH2:14][CH2:15][CH2:16][O:17][c:18]2[c:19]([O:24][CH3:25])[cH:20][cH:21][cH:22][cH:23]2)[c:5](-[c:7]2[cH:8][cH:9][c:10]([Cl:13])[cH:11][cH:12]2)[n:6]1.[K+:46].[K+:47].[OH2:53]>>[c:2]1(-[n:38]2[c:37]([CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH3:36])[n:41][cH:40][cH:39]2)[o:3][c:4]([CH2:14][CH2:15][CH2:16][O:17][c:18]2[c:19]([O:24][CH3:25])[cH:20][cH:21][cH:22][cH:23]2)[c:5](-[c:7]2[cH:8][cH:9][c:10]([Cl:13])[cH:11][cH:12]2)[n:6]1