HRID192621

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID3283

Diethyl Ether

C4H10O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID11450

3-tert-Butylphenol

C10H14O

HCID19660

Carbonate

CO3-2

HCID28557

18-Crown-6

C12H24O6

HCID53722653

未命名化合物

PRODUCTS

生成物

结构：COC(=O)Cc1c(Oc2cccc(C(C)(C)C)c2)ncnc1N(C)C

HCID19069025

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-25f916b6023d4ba9a08be343f3348099
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:16]([CH3:17])([CH3:18])([CH3:19])[c:20]1[cH:21][c:22]([OH:26])[cH:23][cH:24][cH:25]1.[C:27](=[O:28])([O-:29])[O-:30].[CH3:51][N:52]([CH3:53])[CH:54]=[O:55].[CH3:56][CH2:57][O:58][CH2:59][CH3:60].[Cl:1][c:2]1[n:3][cH:4][n:5][c:6]([N:13]([CH3:14])[CH3:15])[c:7]1[CH2:8][C:9](=[O:10])[O:11][CH3:12].[K+:31].[K+:32].[O:33]1[CH2:34][CH2:35][O:36][CH2:37][CH2:38][O:39][CH2:40][CH2:41][O:42][CH2:43][CH2:44][O:45][CH2:46][CH2:47][O:48][CH2:49][CH2:50]1>>[c:2]1([O:26][c:22]2[cH:21][c:20]([C:16]([CH3:17])([CH3:18])[CH3:19])[cH:25][cH:24][cH:23]2)[n:3][cH:4][n:5][c:6]([N:13]([CH3:14])[CH3:15])[c:7]1[CH2:8][C:9](=[O:10])[O:11][CH3:12]