HRID148393

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID887

Methanol

CH4O

HCID947

Nitrogen

HCID3283

Diethyl Ether

C4H10O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID74062

9-Bromoanthracene

C14H9Br

HCID80271

Phosphine, tris(2-methylphenyl)-

C21H21P

HCID105144

Palladium(2+)

Pd+2

结构：COC(=O)C(Cc1cc[c]([Sn]([CH3])([CH3])[CH3])cc1)NC(C)=O

HCID59860633

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(Cc1ccc(-c2c3ccccc3cc3ccccc23)cc1)NC(C)=O

HCID59860620

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-42c556e6f573410cb13315e4eff1b3dc
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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