HRID2329231

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7498

alpha-Bromotoluene

C7H7Br

HCID19660

Carbonate

CO3-2

结构：CCCOc1c(OC)cc(C2CCC(c3cc(OC)c(OC)c(OC)c3)O2)cc1[N+](=O)[O-]

HCID54142498

未命名化合物

PRODUCTS

生成物

结构：CCCOc1c(NCc2ccccc2)cc(C2CCC(c3cc(OC)c(OC)c(OC)c3)O2)cc1OC

HCID54330599

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e2f972422333487eb81be38d375a2725
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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