HRID1227951

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

HCID7498

alpha-Bromotoluene

C7H7Br

HCID8028

Tetrahydrofuran

C4H8O

HCID16028

Tetrabutylammonium

C16H36N+

HCID30165

Iodide ion

I-

HCID166653

Hydride

H-

结构：CCOc1cc(C(CCO)N2C(=O)c3ccccc3C2=O)ccc1OC

HCID21460520

未命名化合物

PRODUCTS

生成物

结构：CCOc1cc(C(CCOCc2ccccc2)N2C(=O)c3ccccc3C2=O)ccc1OC

HCID21460526

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2ed9296f75d24c60b1e19260322d3ae6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[Br:27][CH2:28][c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1.[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][c:6]([CH:12]([CH2:13][CH2:14][OH:15])[N:16]2[C:17](=[O:26])[c:18]3[c:19]([cH:22][cH:23][cH:24][cH:25]3)[C:20]2=[O:21])[cH:7][cH:8][c:9]1[O:10][CH3:11].[CH2:41]([N+:42]([CH2:43][CH2:44][CH2:45][CH3:46])([CH2:47][CH2:48][CH2:49][CH3:50])[CH2:51][CH2:52][CH2:53][CH3:54])[CH2:55][CH2:56][CH3:57].[CH2:58]1[O:59][CH2:60][CH2:61][CH2:62]1.[Cl-:37].[ClH:39].[H-:36].[I-:40].[NH4+:38].[Na+:35]>>[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][c:6]([CH:12]([CH2:13][CH2:14][O:15][CH2:28][c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[N:16]2[C:17](=[O:26])[c:18]3[c:19]([cH:22][cH:23][cH:24][cH:25]3)[C:20]2=[O:21])[cH:7][cH:8][c:9]1[O:10][CH3:11]