HRID681307

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

N,N-Dimethylformamide

C3H7NO

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID78966

9-Borabicyclo[3.3.1]nonane

C8H15B

HCID105144

Palladium(2+)

Pd+2

HCID339432

N-(3-Buten-1-yl)phthalimide

C12H11NO2

HCID18408963

2-[3-(5-Bromo-2-pyridinyl)propyl]-1H-isoindole-1,3(2H)-dione

C16H13BrN2O2

PRODUCTS

生成物

结构：O=C1c2ccccc2C(=O)N1CCCCc1ccc(CCCN2C(=O)c3ccccc3C2=O)nc1

HCID18408985

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-285c3f5e608840baa6b947e232bdbf52
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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