HRID1227552

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID887

Methanol

CH4O

2 次

HCID923

Sodium ion

Na+

HCID6212

Chloroform

CHCl3

HCID498716

未命名化合物

HCID10725881

N-BOC-(methylamino)acetaldehyde

C8H15NO3

HCID57831258

未命名化合物

PRODUCTS

生成物

结构：CN(CCN1CCC(c2ccccc2)(N(C)C)CC1)C(=O)OC(C)(C)C

HCID68408263

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5806755b43384fb08d032a454a52c9af
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

[C:28]([BH3-:29])#[N:30].[CH3:16][N:17]([C:18]([O:19][C:20]([CH3:21])([CH3:22])[CH3:23])=[O:24])[CH2:25][CH:26]=[O:27].[CH3:1][N:2]([C:3]1([c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[CH2:4][CH2:5][NH:6][CH2:7][CH2:8]1)[CH3:15].[CH3:32][OH:33].[CH3:34][C:35](=[O:36])[OH:37].[CH3:38][OH:39].[Cl:40][CH:41]([Cl:42])[Cl:43].[Na+:31]>>[CH3:1][N:2]([C:3]1([c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[CH2:4][CH2:5][N:6]([CH2:26][CH2:25][N:17]([CH3:16])[C:18]([O:19][C:20]([CH3:21])([CH3:22])[CH3:23])=[O:24])[CH2:7][CH2:8]1)[CH3:15]