HRID2348056

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID6342

Acetonitrile

C2H3N

HCID8471

Triethylamine

C6H15N

HCID12286

3-Bromopyridine

C5H4BrN

HCID80271

Phosphine, tris(2-methylphenyl)-

C21H21P

HCID105144

Palladium(2+)

Pd+2

HCID13905156

tert-Butyl 2-ethenylpyrrolidine-1-carboxylate

C11H19NO2

PRODUCTS

生成物

HCID69588975

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-892be8dc94ad4ff792a3aaabd992f83c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[Br:1][c:2]1[cH:3][n:4][cH:5][cH:6][cH:7]1.[C:8]([CH3:9])([CH3:10])([CH3:11])[O:12][C:13](=[O:14])[N:15]1[CH:16]([CH:20]=[CH2:21])[CH2:17][CH2:18][CH2:19]1.[CH3:58][C:59]#[N:60].[CH3:61][CH2:62][N:63]([CH2:64][CH3:65])[CH2:66][CH3:67].[Na+:48].[O-:44][C:45]([OH:46])=[O:47].[O-:50][C:51]([CH3:52])=[O:53].[O-:54][C:55]([CH3:56])=[O:57].[Pd+2:49].[c:22]1([CH3:23])[cH:24][cH:25][cH:26][cH:27][c:28]1[P:29]([c:30]1[cH:31][cH:32][cH:33][cH:34][c:35]1[CH3:36])[c:37]1[cH:38][cH:39][cH:40][cH:41][c:42]1[CH3:43]>>[c:2]1([CH:21]=[CH:20][CH:16]2[N:15]([C:13]([O:12][C:8]([CH3:9])([CH3:10])[CH3:11])=[O:14])[CH2:19][CH2:18][CH2:17]2)[cH:3][n:4][cH:5][cH:6][cH:7]1