HRID941476

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID284

Formic acid

CH2O2

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

结构：COc1ccc(C(C)C)cc1-c1ccc(C(F)(F)F)cc1CNCc1cc(C(F)(F)F)cc(C(F)(F)F)c1

HCID59343883

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C(C)C)cc1-c1ccc(C(F)(F)F)cc1CN(C=O)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1

HCID11585033

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7c0c95eed9e14b7b8d965d18f7ce86f2
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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