HRID95874

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID8028

Tetrahydrofuran

C4H8O

HCID31275

1,4-Dioxane

C4H8O2

HCID14973229

5-(Pyridin-4-yl)-1H-indole

C13H10N2

HCID21559975

未命名化合物

PRODUCTS

生成物

HCID259

Bromide

Br-

结构：CC(=O)N1CC(CC[n+]2ccc(-c3ccc4[nH]ccc4c3)cc2)c2ccccc21

HCID68852829

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-261bda2d8364427ab96d3675a4147652
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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