HRID2142825

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID813

Potassium cation

K+

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6228

Dimethylformamide

C3H7NO

HCID7498

alpha-Bromotoluene

C7H7Br

HCID30165

Iodide ion

I-

HCID178451217

未命名化合物

PRODUCTS

产物

HCID178451215

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-5c8e819b841a4b9bb2ac094191814be7
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

[Br:34][CH2:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[C:1](=[O:2])([OH:3])[CH:4]([CH2:5][CH2:6][CH:7]1[CH2:8][CH2:9][CH2:10][CH2:11][CH2:12]1)[NH:13][CH:14]1[CH2:15][O:16][c:17]2[c:18]([cH:30][cH:31][cH:32][cH:33]2)[N:19]([CH2:22][C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[C:20]1=[O:21].[C:42](=[O:43])([OH:44])[O-:45].[CH3:49][N:50]([CH3:51])[CH:52]=[O:53].[I-:48].[K+:47].[Na+:46].[OH2:54]>>[C:1]([O:2][CH2:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1)(=[O:3])[CH:4]([CH2:5][CH2:6][CH:7]1[CH2:8][CH2:9][CH2:10][CH2:11][CH2:12]1)[NH:13][CH:14]1[CH2:15][O:16][c:17]2[c:18]([cH:30][cH:31][cH:32][cH:33]2)[N:19]([CH2:22][C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[C:20]1=[O:21]