HRID159272

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID923

Sodium ion

Na+

HCID1001

Phenethylamine

C8H11N

HCID6344

Dichloromethane

CH2Cl2

HCID2724942

未命名化合物

HCID86633167

(2'-Formyl-6-methoxy-4'-trifluoromethyl-biphenyl-3-yl)-acetic acid methyl ester

C18H15F3O4

PRODUCTS

产物

HCID66607670

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-6da1cece28174f62b3371627a2ea9f59
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应SMILES

[C:35]([O:36][BH-:37]([O:38][C:39](=[O:40])[CH3:41])[O:42][C:43](=[O:44])[CH3:45])(=[O:46])[CH3:47].[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][c:7](-[c:13]2[c:14]([CH:23]=[O:24])[cH:15][c:16]([C:19]([F:20])([F:21])[F:22])[cH:17][cH:18]2)[c:8]([O:11][CH3:12])[cH:9][cH:10]1)=[O:25].[CH3:49][C:50](=[O:51])[OH:52].[Cl:53][CH2:54][Cl:55].[NH2:26][CH2:27][CH2:28][c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1.[Na+:48]>>[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][c:7](-[c:13]2[c:14]([CH2:23][NH:26][CH2:27][CH2:28][c:29]3[cH:30][cH:31][cH:32][cH:33][cH:34]3)[cH:15][c:16]([C:19]([F:20])([F:21])[F:22])[cH:17][cH:18]2)[c:8]([O:11][CH3:12])[cH:9][cH:10]1)=[O:25]