HRID1115066

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

3 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8108

Butyl vinyl ether

C6H12O

结构：c1ccc(P(CCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1

HCID81219

Phosphine, 1,3-propanediylbis[diphenyl-

C27H26P2

HCID81531

Diisopropylethylamine

C8H19N

HCID105005

Thallous cation

Tl+

HCID105144

Palladium(2+)

Pd+2

结构：CCOC(=O)c1c(OCc2ccccc2)c2n(c1Br)CCN(C)C2=O

HCID68866169

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1c(OCc2ccccc2)c2n(c1C(C)=O)CCN(C)C2=O

HCID68866335

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7fe83c13facf491c8698550709979146
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[C:26]([CH3:27])(=[O:28])[O-:29].[C:81]([O-:82])(=[O:83])[CH3:84].[C:86]([O-:87])(=[O:88])[CH3:89].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([C:21](=[O:22])[O:23][CH2:24][CH3:25])[c:11]([Br:20])[n:12]2[c:13]1[C:14](=[O:19])[N:15]([CH3:18])[CH2:16][CH2:17]2.[CH:31]([N:32]([CH:33]([CH3:34])[CH3:35])[CH2:36][CH3:37])([CH3:38])[CH3:39].[CH:69]([O:70][CH2:71][CH2:72][CH2:73][CH3:74])=[CH2:75].[O:76]=[CH:77][N:78]([CH3:79])[CH3:80].[Pd+2:85].[Tl+:30].[c:40]1([P:41]([c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[CH2:48][CH2:49][CH2:50][P:51]([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[cH:64][cH:65][cH:66][cH:67][cH:68]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([C:21](=[O:22])[O:23][CH2:24][CH3:25])[c:11]([C:26]([CH3:27])=[O:28])[n:12]2[c:13]1[C:14](=[O:19])[N:15]([CH3:18])[CH2:16][CH2:17]2