HRID1134602

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

HCID8028

Tetrahydrofuran

C4H8O

HCID11201

Ethylidene bromide

C2H4Br2

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

HCID618233

1-Tritylimidazole-4-carboxaldehyde

C23H18N2O

HCID5462224

Magnesium

HCID14520336

8-Bromo-6-chloro-2,2-dimethyl-4H-1,3-benzodioxin

C10H10BrClO2

PRODUCTS

生成物

结构：CC1(C)OCc2cc(Cl)cc(C(O)c3cn(C(c4ccccc4)(c4ccccc4)c4ccccc4)cn3)c2O1

HCID14520340

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6e718efb451943b8b6f84213280a9260
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[Br:1][CH:2]([Br:3])[CH3:4].[Br:6][c:7]1[cH:8][c:9]([Cl:19])[cH:10][c:11]2[c:12]1[O:13][C:14]([CH3:17])([CH3:18])[O:15][CH2:16]2.[Cl-:46].[Mg:5].[NH4+:47].[O:48]1[CH2:49][CH2:50][CH2:51][CH2:52]1.[OH2:53].[c:20]1([C:26]([n:27]2[cH:28][n:29][c:30]([CH:32]=[O:33])[cH:31]2)([c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[cH:21][cH:22][cH:23][cH:24][cH:25]1>>[c:7]1([CH:32]([c:30]2[n:29][cH:28][n:27]([C:26]([c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)([c:34]3[cH:35][cH:36][cH:37][cH:38][cH:39]3)[c:40]3[cH:41][cH:42][cH:43][cH:44][cH:45]3)[cH:31]2)[OH:33])[cH:8][c:9]([Cl:19])[cH:10][c:11]2[c:12]1[O:13][C:14]([CH3:17])([CH3:18])[O:15][CH2:16]2