HRID150881

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6344

Dichloromethane

CH2Cl2

HCID7504

Benzylamine

C7H9N

HCID2724942

未命名化合物

结构：CCOC(=O)C1C(C=O)CCC(OC(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1c1ccc(F)cc1

HCID178469314

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C1C(CNCc2ccccc2)CCC(OC(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1c1ccc(F)cc1

HCID178469209

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4cbcafb13f874cf98b9af80ee86741ae
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:46]([O:47][BH-:48]([O:49][C:50](=[O:51])[CH3:52])[O:53][C:54](=[O:55])[CH3:56])(=[O:57])[CH3:58].[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH:6]1[CH:7]([c:31]2[cH:32][cH:33][c:34]([F:37])[cH:35][cH:36]2)[CH:8]([O:14][CH:15]([CH3:16])[c:17]2[cH:18][c:19]([C:27]([F:28])([F:29])[F:30])[cH:20][c:21]([C:23]([F:24])([F:25])[F:26])[cH:22]2)[CH2:9][CH2:10][CH:11]1[CH:12]=[O:13].[CH2:38]([c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1)[NH2:45].[Cl:60][CH2:61][Cl:62].[Na+:59]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH:6]1[CH:7]([c:31]2[cH:32][cH:33][c:34]([F:37])[cH:35][cH:36]2)[CH:8]([O:14][CH:15]([CH3:16])[c:17]2[cH:18][c:19]([C:27]([F:28])([F:29])[F:30])[cH:20][c:21]([C:23]([F:24])([F:25])[F:26])[cH:22]2)[CH2:9][CH2:10][CH:11]1[CH2:12][NH:45][CH2:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1