HRID152337

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

HCID123062

1-(Bromomethyl)-4-(trifluoromethyl)benzene

C8H6BrF3

HCID11020635

3-benzyloxy-4-hydroxybenzaldehyde

C14H12O3

PRODUCTS

生成物

结构：O=Cc1ccc(OCc2ccc(C(F)(F)F)cc2)c(OCc2ccccc2)c1

HCID21957495

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c20f1bfd50ab4d40bdea5d760f20e94b
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:30](=[O:31])([O-:32])[O-:33].[CH2:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[O:20][c:21]1[cH:22][c:23]([CH:24]=[O:25])[cH:26][cH:27][c:28]1[OH:29].[CH3:36][N:37]([CH3:38])[CH:39]=[O:40].[CH3:41][CH2:42][O:43][C:44](=[O:45])[CH3:46].[Cs+:34].[Cs+:35].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([CH2:7][Br:8])[cH:9][cH:10]1)([F:11])[F:12]>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([CH2:7][O:29][c:28]2[c:21]([O:20][CH2:13][c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[cH:22][c:23]([CH:24]=[O:25])[cH:26][cH:27]2)[cH:9][cH:10]1)([F:11])[F:12]