HRID112747

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

2 次

HCID1049

Pyridine

C5H5N

HCID1117

Sulfate

O4S-2

HCID4067665

Methoxyazanium

CH6NO+

结构：CC(C)CC1CC(C#CC(=O)C(CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)CC(=O)OC(C)(C)C)C1

HCID71127321

未命名化合物

PRODUCTS

生成物

结构：CON=C(C#CC1CC(CC(C)C)C1)C(CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)CC(=O)OC(C)(C)C

HCID86675035

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e7a3b1781db84b8c8ae6a61151ba1310
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([O:6][CH2:7][CH2:8][CH:9]([CH2:10][C:11](=[O:12])[O:13][C:14]([CH3:15])([CH3:16])[CH3:17])[C:18]([C:19]#[C:20][CH:21]1[CH2:22][CH:23]([CH2:25][CH:26]([CH3:27])[CH3:28])[CH2:24]1)=[O:29])([c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)[c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[CH3:42][OH:43].[CH3:52][O:53][NH3+:54].[Cl-:51].[Na+:44].[Na+:45].[O-:46][S:47](=[O:48])(=[O:49])[O-:50].[cH:55]1[cH:56][cH:57][n:58][cH:59][cH:60]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([O:6][CH2:7][CH2:8][CH:9]([CH2:10][C:11](=[O:12])[O:13][C:14]([CH3:15])([CH3:16])[CH3:17])[C:18]([C:19]#[C:20][CH:21]1[CH2:22][CH:23]([CH2:25][CH:26]([CH3:27])[CH3:28])[CH2:24]1)=[N:54][O:53][CH3:52])([c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)[c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1