HRID190839

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

HCID69637

Propanedioic acid, 2-bromo-, 1,3-diethyl ester

C7H11BrO4

HCID135854828

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(Oc1cc2nccc(Oc3cc4ccccc4nc3C)c2cc1OC)C(=O)OCC

HCID57756541

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6adec7ddd412463593a4bb9f8ba85ff9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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