HRID818931

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID240

Benzaldehyde

C7H6O

HCID312

Chloride

Cl-

HCID7912

Diisopropylamine

C6H15N

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

n-Hexane

C6H14

HCID4175931

未命名化合物

HCID178418339

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C1CC(C(O)c2ccccc2)C(=O)N1C(=O)OC(C)(C)C

HCID178498212

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-65b05e7b74394d4db28881982fb5c267
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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