HRID1569840

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID888

Magnesium cation

Mg+2

HCID962

Water

H2O

HCID6212

Chloroform

CHCl3

HCID7943

Dimethyl malonate

C5H8O4

HCID7972

4-Methylmorpholine

C5H11NO

HCID2758875

Trifluoromethanesulfonate

CF3O3S-

2 次

结构：COC(=O)C(=Cc1c(OC)cc(OC)cc1OC)[N+](=O)[O-]

HCID85535481

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(C(=O)OC)C(c1c(OC)cc(OC)cc1OC)C(C(=O)OC)[N+](=O)[O-]

HCID72254933

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2e7d17a5c9424f639e3bc280401eca2d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[C:40]([CH2:41][C:42](=[O:43])[O:44][CH3:45])(=[O:46])[O:47][CH3:48].[CH3:19][O:20][C:21]([C:22](=[CH:23][c:24]1[c:25]([O:34][CH3:35])[cH:26][c:27]([O:32][CH3:33])[cH:28][c:29]1[O:30][CH3:31])[N+:36](=[O:37])[O-:38])=[O:39].[CH3:49][N:50]1[CH2:51][CH2:52][O:53][CH2:54][CH2:55]1.[CH3:56][OH:57].[CH:58]([Cl:59])([Cl:60])[Cl:61].[Mg+2:9].[OH2:18].[S:10]([O-:11])([C:12]([F:13])([F:14])[F:15])(=[O:16])=[O:17].[S:1]([O-:2])([C:3]([F:4])([F:5])[F:6])(=[O:7])=[O:8]>>[CH3:19][O:20][C:21]([CH:22]([CH:23]([c:24]1[c:25]([O:34][CH3:35])[cH:26][c:27]([O:32][CH3:33])[cH:28][c:29]1[O:30][CH3:31])[CH:41]([C:40](=[O:46])[O:47][CH3:48])[C:42](=[O:43])[O:44][CH3:45])[N+:36](=[O:37])[O-:38])=[O:39]