HRID183681

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID6344

Dichloromethane

CH2Cl2

HCID6422

未命名化合物

HCID11097910

N-Benzyl-1-butoxy-N-[(trimethylsilyl)methyl]methanamine

C16H29NOSi

HCID21261039

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C1=C(C2(NC(=O)OC(C)(C)C)CC2)CN(Cc2ccccc2)C1

HCID21261012

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b7d0836d291145cb8cab49236ab7eb33
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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