HRID281284

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID260

Hydrogen Bromide

BrH

HCID313

Hydrochloric Acid

ClH

HCID813

Potassium cation

K+

2 次

HCID6569

Methyl ethyl ketone

C4H8O

HCID19660

Carbonate

CO3-2

HCID10244523

Ethyl 1-(2-bromoethyl)-3-piperidinecarboxylate

C10H18BrNO2

HCID18787216

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C1CCCN(CCN(C)C2c3ccccc3CCc3ccccc32)C1

HCID50852342

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6f3e0ea5da5341a5af74a234c76426cb
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

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