HRID306331

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID962

Water

H2O

HCID8857

Ethyl acetate

C4H8O2

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID23978

Copper

HCID24290

未命名化合物

HCID79288

4-Bromo-3-nitroanisole

C7H6BrNO3

HCID23087420

3-Bromo-1,2-dihydro-7-(phenylmethoxy)naphthalene

C17H15BrO

PRODUCTS

生成物

结构：COc1ccc(C2=Cc3ccc(OCc4ccccc4)cc3CC2)c([N+](=O)[O-])c1

HCID23087493

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-93c85d8498f54264b6ec7350cd1d3c95
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[Br:20][c:21]1[c:22]([N+:29](=[O:30])[O-:31])[cH:23][c:24]([O:27][CH3:28])[cH:25][cH:26]1.[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]2[c:17]([cH:18]1)[CH2:16][CH2:15][C:14]([Br:19])=[CH:13]2.[CH3:32][CH2:33][O:34][C:35](=[O:36])[CH3:37].[CH3:39][S:40](=[O:41])[CH3:42].[Cu:84].[OH2:38].[Pd:43]([Cl:44])[Cl:45].[c:46]1([P:47]([c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)[c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)[cH:60][cH:61][cH:62][cH:63][cH:64]1.[c:65]1([P:66]([c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)[c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)[cH:79][cH:80][cH:81][cH:82][cH:83]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]2[c:17]([cH:18]1)[CH2:16][CH2:15][C:14]([c:21]1[c:22]([N+:29](=[O:30])[O-:31])[cH:23][c:24]([O:27][CH3:28])[cH:25][cH:26]1)=[CH:13]2