HRID313213

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID271

Calcium ion

Ca+2

HCID312

Chloride

Cl-

2 次

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID166653

Hydride

H-

HCID2724271

2-Chloromethyl 2-(trimethylsilyl)ethyl ether

C6H15ClOSi

结构：O=c1[nH]c2cccnc2n1-c1ccc(OCc2ccccc2)cc1

HCID58577661

未命名化合物

PRODUCTS

生成物

结构：C[Si](C)(C)CCOCn1c(=O)n(-c2ccc(OCc3ccccc3)cc2)c2ncccc21

HCID58577627

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0e8c1ee96c7d42a3a432dda617c7919e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH2:10]([c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)[O:17][c:18]1[cH:19][cH:20][c:21](-[n:24]2[c:25](=[O:33])[nH:26][c:27]3[c:28]2[n:29][cH:30][cH:31][cH:32]3)[cH:22][cH:23]1.[CH3:44][OH:45].[Ca+2:37].[Cl-:36].[Cl-:38].[Cl:1][CH2:2][O:3][CH2:4][CH2:5][Si:6]([CH3:7])([CH3:8])[CH3:9].[H-:34].[Na+:35].[O:39]=[CH:40][N:41]([CH3:42])[CH3:43]>>[CH2:2]([O:3][CH2:4][CH2:5][Si:6]([CH3:7])([CH3:8])[CH3:9])[n:26]1[c:25](=[O:33])[n:24](-[c:21]2[cH:20][cH:19][c:18]([O:17][CH2:10][c:11]3[cH:12][cH:13][cH:14][cH:15][cH:16]3)[cH:23][cH:22]2)[c:28]2[c:27]1[cH:32][cH:31][cH:30][n:29]2