HRID1229082

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID813

Potassium cation

K+

2 次

HCID6228

Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID74786

4-Pentenoic acid, ethyl ester

C7H12O2

HCID78966

9-Borabicyclo[3.3.1]nonane

C8H15B

HCID105144

Palladium(2+)

Pd+2

HCID23435509

6-Bromo-N-[(4-methoxyphenyl)methyl]pyridin-2-amine

C13H13BrN2O

PRODUCTS

产物

反应SMILES：CCOC(=O)CCCCc1cccc(NCc2ccc(OC)cc2)n1

HCID70092570

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-a0742b96b304450592f6afb0f4e59a7a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应SMILES

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