HRID824139

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID174

Ethylene glycol

C2H6O2

HCID888

Magnesium cation

Mg+2

HCID1117

Sulfate

O4S-2

HCID1140

Toluene

C7H8

HCID6101

4-Methylbenzenesulfonic acid

C7H8O3S

HCID8857

Ethyl acetate

C4H8O2

结构：Cc1cc(N(Cc2ccccc2)Cc2ccccc2)c(C)cc1C=O

HCID57461074

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(N(Cc2ccccc2)Cc2ccccc2)c(C)cc1C1OCCO1

HCID57461075

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-586d14e7fd944ac4afb0d3484101b30f
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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