HRID87189

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID1140

Toluene

C7H8

HCID4610

1,2-Cyclohexanediamine

C6H14N2

HCID8857

Ethyl acetate

C4H8O2

HCID12025

2-Pyrrolidinone

C4H7NO

HCID19660

Carbonate

CO3-2

HCID24350

Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

CuI

HCID66661920

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)C1(c2ccc(N3CCCC3=O)cc2)CC1

HCID66661882

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ba320bb8c01f40ecbf986f6fc5cea8ba
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[Br:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([C:11](=[O:12])[O:13][C:14]([CH3:15])([CH3:16])[CH3:17])[CH2:9][CH2:10]2)[cH:6][cH:7]1.[C:32](=[O:33])([O-:34])[O-:35].[CH3:40][CH2:41][O:42][C:43](=[O:44])[CH3:45].[CH3:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[CH:24]1([NH2:25])[CH2:26][CH2:27][CH2:28][CH2:29][CH:30]1[NH2:31].[Cu:38][I:39].[K+:36].[K+:37].[O:18]=[C:19]1[NH:20][CH2:21][CH2:22][CH2:23]1>>[c:2]1([N:20]2[C:19](=[O:18])[CH2:23][CH2:22][CH2:21]2)[cH:3][cH:4][c:5]([C:8]2([C:11](=[O:12])[O:13][C:14]([CH3:15])([CH3:16])[CH3:17])[CH2:9][CH2:10]2)[cH:6][cH:7]1