HRID112070

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID11773

Triphenylarsine

C18H15As

HCID23938

Palladium

2 次

HCID31275

1,4-Dioxane

C4H8O2

HCID95417

1,5-Diphenyl-1,4-pentadien-3-one

C17H14O

3 次

结构：[CH3][Sn]([CH3])([CH3])[c]1ccc([N+](=O)[O-])cc1

HCID9971210

Stannane, trimethyl(4-nitrophenyl)-

C9H13NO2Sn

HCID18175122

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)CCCc1c(-c2ccc([N+](=O)[O-])cc2)[nH]c2ccc(Cl)cc12

HCID18175159

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a89e5136f45f43339bc3c8f22abaadd3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[Br:1][c:2]1[nH:3][c:4]2[cH:5][cH:6][c:7]([Cl:19])[cH:8][c:9]2[c:10]1[CH2:11][CH2:12][CH2:13][C:14](=[O:15])[O:16][CH2:17][CH3:18].[CH3:20][Sn:21]([c:22]1[cH:23][cH:24][c:25]([N+:28](=[O:29])[O-:30])[cH:26][cH:27]1)([CH3:31])[CH3:32].[O:52]1[CH2:53][CH2:54][O:55][CH2:56][CH2:57]1.[O:60]=[C:61]([CH:62]=[CH:63][c:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1)[CH:70]=[CH:71][c:72]1[cH:73][cH:74][cH:75][cH:76][cH:77]1.[O:78]=[C:79]([CH:80]=[CH:81][c:82]1[cH:83][cH:84][cH:85][cH:86][cH:87]1)[CH:88]=[CH:89][c:90]1[cH:91][cH:92][cH:93][cH:94][cH:95]1.[O:96]=[C:97]([CH:98]=[CH:99][c:100]1[cH:101][cH:102][cH:103][cH:104][cH:105]1)[CH:106]=[CH:107][c:108]1[cH:109][cH:110][cH:111][cH:112][cH:113]1.[OH2:114].[Pd:58].[Pd:59].[cH:33]1[cH:34][cH:35][c:36]([As:37]([c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)[cH:50][cH:51]1>>[c:2]1(-[c:22]2[cH:23][cH:24][c:25]([N+:28](=[O:29])[O-:30])[cH:26][cH:27]2)[nH:3][c:4]2[cH:5][cH:6][c:7]([Cl:19])[cH:8][c:9]2[c:10]1[CH2:11][CH2:12][CH2:13][C:14](=[O:15])[O:16][CH2:17][CH3:18]