HRID295156

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID5943

Carbon tetrachloride

CCl4

HCID6547

Azobisisobutyronitrile

C8H12N4

HCID8071

未命名化合物

HCID67184

1-Bromopyrrolidine-2,5-dione

C4H4BrNO2

HCID74438

3-(1,1,2,2-Tetrafluoroethoxy)toluene

C9H8F4O

HCID166653

Hydride

H-

HCID2760258

ethyl 3-oxo-3-(4-phenoxyphenyl)propanoate

C17H16O4

HCID11460378

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(Cc1cccc(OC(F)(F)C(F)F)c1)C(=O)c1ccc(Oc2ccccc2)cc1

HCID22261740

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-82aa108f542248e6adaf8fb6d7098822
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[Br:15][N:16]1[C:17](=[O:18])[CH2:19][CH2:20][C:21]1=[O:22].[C:73]([Cl:74])([Cl:75])([Cl:76])[Cl:77].[CH3:78][O:79][CH2:80][CH2:81][O:82][CH3:83].[F:1][C:2]([CH:3]([F:4])[F:5])([O:6][c:7]1[cH:8][c:9]([CH3:13])[cH:10][cH:11][cH:12]1)[F:14].[F:58][C:59]([F:60])([O:61][c:62]1[cH:63][c:64]([CH2:65][Br:66])[cH:67][cH:68][cH:69]1)[CH:70]([F:71])[F:72].[H-:56].[N:23]([C:24]([CH3:25])([CH3:26])[C:27]#[N:28])=[N:29][C:30]([CH3:31])([CH3:32])[C:33]#[N:34].[Na+:57].[O:35]([c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1)[c:42]1[cH:43][cH:44][c:45]([C:48]([CH2:49][C:50](=[O:51])[O:52][CH2:53][CH3:54])=[O:55])[cH:46][cH:47]1.[OH2:84]>>[F:1][C:2]([CH:3]([F:4])[F:5])([O:6][c:7]1[cH:8][c:9]([CH2:13][CH:49]([C:48]([c:45]2[cH:44][cH:43][c:42]([O:35][c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[cH:47][cH:46]2)=[O:55])[C:50](=[O:51])[O:52][CH2:53][CH3:54])[cH:10][cH:11][cH:12]1)[F:14]