HRID2142287

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID784

Hydrogen peroxide

H2O2

HCID887

Methanol

CH4O

HCID1140

Toluene

C7H8

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID74342

3-Benzyloxybenzaldehyde

C14H12O2

HCID2758875

Trifluoromethanesulfonate

CF3O3S-

HCID5360545

Sodium

HCID22926797

未命名化合物

HCID178440531

未命名化合物

PRODUCTS

生成物

结构：CC(C)OC(C(=O)N1C(=O)OCC1Cc1ccccc1)C(O)c1cccc(OCc2ccccc2)c1

HCID69008500

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7e26208786b84b699ba50608f8fa70f8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH:8]1[N:9]([C:14]([CH2:15][O:16][CH:17]([CH3:18])[CH3:19])=[O:20])[C:10](=[O:13])[O:11][CH2:12]1.[CH2:29]([B+:30][CH2:31][CH2:32][CH2:33][CH3:34])[CH2:35][CH2:36][CH3:37].[CH2:38]([c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1)[O:45][c:46]1[cH:47][c:48]([CH:49]=[O:50])[cH:51][cH:52][cH:53]1.[CH3:57][OH:58].[CH3:62][CH2:63][N:64]([CH2:65][CH3:66])[CH2:67][CH3:68].[CH3:69][c:70]1[cH:71][cH:72][cH:73][cH:74][cH:75]1.[Cl:59][CH2:60][Cl:61].[Na:54].[OH:55][OH:56].[S:21]([O-:22])([C:23]([F:24])([F:25])[F:26])(=[O:27])=[O:28]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH:8]1[N:9]([C:14]([CH:15]([O:16][CH:17]([CH3:18])[CH3:19])[CH:49]([c:48]2[cH:47][c:46]([O:45][CH2:38][c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)[cH:53][cH:52][cH:51]2)[OH:50])=[O:20])[C:10](=[O:13])[O:11][CH2:12]1