HRID313970

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID798

Indole

C8H7N

HCID13059268

3,4-Dibromo-1-phenyl-1H-pyrrole-2,5-dione

C10H5Br2NO2

结构：O=C1NC(=O)C(c2cn3c4c(cccc24)CCC3)C1c1c[nH]c2ccccc12

HCID57355660

未命名化合物

HCID178477777

未命名化合物

PRODUCTS

生成物

结构：O=C1C(Br)=C(c2c[nH]c3ccccc23)C(=O)N1c1ccccc1

HCID67017068

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-09882315aedb441b92f91d707cf62cc3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[Br-:53].[Br:38][C:39]1=[C:43]([Br:44])[C:42](=[O:45])[N:41]([c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[C:40]1=[O:52].[CH3:54][Mg+:55].[c:1]1([CH:2]2[CH:3]([c:4]3[c:5]4[c:6]([cH:7][cH:8][cH:9][cH:10]4)[nH:11][cH:12]3)[C:13](=[O:14])[NH:15][C:16]2=[O:17])[c:18]2[c:19]3[c:20]([cH:21][cH:22][cH:23]2)[CH2:24][CH2:25][CH2:26][n:27]3[cH:28]1.[cH:29]1[cH:30][cH:31][c:32]2[nH:33][cH:34][cH:35][c:36]2[cH:37]1>>[cH:29]1[cH:30][cH:31][c:32]2[nH:33][cH:34][c:35]([C:43]3=[C:39]([Br:38])[C:40](=[O:52])[N:41]([c:46]4[cH:47][cH:48][cH:49][cH:50][cH:51]4)[C:42]3=[O:45])[c:36]2[cH:37]1