HRID935668

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

HCID15413

Methyl tert-butyl ether

C5H12O

HCID27099

Copper(2+)

Cu+2

HCID58579863

未命名化合物

HCID178517722

未命名化合物

PRODUCTS

生成物

结构：COc1cc(-n2ccc(C#Cc3ccccc3)nc2=O)ccc1OCC(C)(C)O

HCID46927044

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a1b64f46c6a84752b2d39fbba05074c5
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:41]([O:42][CH3:43])([CH3:44])([CH3:45])[CH3:46].[C:53]([O-:54])(=[O:55])[CH3:56].[C:58]([O-:59])(=[O:60])[CH3:61].[CH3:33][N:34]([CH3:35])[CH2:36][CH2:37][N:38]([CH3:39])[CH3:40].[CH3:47][OH:48].[Cl:50][CH2:51][Cl:52].[Cu+2:57].[OH2:49].[OH:16][C:17]([CH2:18][O:19][c:20]1[c:21]([O:29][CH3:30])[cH:22][c:23]([B:26]([OH:27])[OH:28])[cH:24][cH:25]1)([CH3:31])[CH3:32].[c:1]1([C:7]#[C:8][c:9]2[n:10][c:11](=[O:15])[nH:12][cH:13][cH:14]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7]#[C:8][c:9]2[n:10][c:11](=[O:15])[n:12](-[c:23]3[cH:22][c:21]([O:29][CH3:30])[c:20]([O:19][CH2:18][C:17]([OH:16])([CH3:31])[CH3:32])[cH:25][cH:24]3)[cH:13][cH:14]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1