HRID2154267

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID923

Sodium ion

Na+

HCID7134

Benzeneacetic acid, 2-methoxy-

C9H10O3

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

n-Hexane

C6H14

HCID8857

Ethyl acetate

C4H8O2

HCID166653

Hydride

H-

HCID250174

未命名化合物

HCID178418339

未命名化合物

PRODUCTS

生成物

结构：COc1ccccc1CC(=O)N1C(=O)OC(c2ccccc2)C1C

HCID21264537

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-338f64cefe3e4f50823970d28867f159
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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