HRID105526

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID962

Water

H2O

HCID6328

Methyl iodide

CH3I

HCID8028

Tetrahydrofuran

C4H8O

HCID236858

2-bromo-6-ethoxynaphthalene

C12H11BrO

结构：O=Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1

HCID618233

1-Tritylimidazole-4-carboxaldehyde

C23H18N2O

HCID5462224

Magnesium

PRODUCTS

生成物

结构：CCOc1ccc2cc(C(O)c3cn(C(c4ccccc4)(c4ccccc4)c4ccccc4)cn3)ccc2c1

HCID22664975

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c5f0126390844a7d88e44a8f99fbb522
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:1][c:2]1[cH:3][c:4]2[cH:5][cH:6][c:7]([O:12][CH2:13][CH3:14])[cH:8][c:9]2[cH:10][cH:11]1.[CH2:46]1[O:47][CH2:48][CH2:49][CH2:50]1.[CH3:16][I:17].[CH:18](=[O:19])[c:20]1[n:21][cH:22][n:23]([C:25]([c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)([c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[cH:24]1.[Cl-:44].[Mg:15].[NH4+:45].[OH2:51]>>[c:2]1([CH:18]([OH:19])[c:20]2[n:21][cH:22][n:23]([C:25]([c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)([c:32]3[cH:33][cH:34][cH:35][cH:36][cH:37]3)[c:38]3[cH:39][cH:40][cH:41][cH:42][cH:43]3)[cH:24]2)[cH:3][c:4]2[cH:5][cH:6][c:7]([O:12][CH2:13][CH3:14])[cH:8][c:9]2[cH:10][cH:11]1