HRID677264

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID887

Methanol

CH4O

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID8037

N,N,N',N'-Tetramethylethylenediamine

C6H16N2

HCID23978

Copper

HCID27099

Copper(2+)

Cu+2

HCID61668

Boronic acid

H3BO2

HCID58579863

未命名化合物

HCID178517730

未命名化合物

PRODUCTS

生成物

结构：COc1cc(-n2ccc(C=Cc3ccc(Cl)cc3)nc2=O)ccc1OCC(C)(C)O

HCID67135622

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fd0a6929a08c449498b434e7de09fc0a
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

[BH:42]([OH:43])[OH:44].[C:51]([O-:52])(=[O:53])[CH3:54].[C:56]([O-:57])(=[O:58])[CH3:59].[CH3:34][N:35]([CH3:36])[CH2:37][CH2:38][N:39]([CH3:40])[CH3:41].[CH3:45][OH:46].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:6]=[CH:7][c:8]2[n:9][c:10](=[O:14])[nH:11][cH:12][cH:13]2)[cH:15][cH:16]1.[Cl:48][CH2:49][Cl:50].[Cu+2:55].[Cu:60].[OH2:47].[OH:17][C:18]([CH2:19][O:20][c:21]1[c:22]([O:30][CH3:31])[cH:23][c:24]([B:27]([OH:28])[OH:29])[cH:25][cH:26]1)([CH3:32])[CH3:33]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:6]=[CH:7][c:8]2[n:9][c:10](=[O:14])[n:11](-[c:24]3[cH:23][c:22]([O:30][CH3:31])[c:21]([O:20][CH2:19][C:18]([OH:17])([CH3:32])[CH3:33])[cH:26][cH:25]3)[cH:12][cH:13]2)[cH:15][cH:16]1