HRID110019

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID179502

2-(2-Methoxyphenyl)acetyl chloride

C9H9ClO2

结构：COc1ccccc1C1=CCC(c2ccccc2)(c2ccccc2)C2CNCC12

HCID178489281

未命名化合物

PRODUCTS

生成物

结构：COc1ccccc1CC(=O)N1CC2C(c3ccccc3OC)=CCC(c3ccccc3)(c3ccccc3)C2C1

HCID178489464

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-70d59d548bbe46cbb40e05110784b0d3
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

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