HRID300518

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID30165

Iodide ion

I-

HCID59216392

未命名化合物

HCID59216413

(2,6-Dibromophenyl)methyl acetate

C9H8Br2O2

PRODUCTS

生成物

结构：CCN(C)c1ccc2c(c1)CCN(c1cccc(Br)c1COC(C)=O)C2=O

HCID59216502

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c90ed2c8ce2140aeab2600971974c0e9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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