HRID2338333

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID31275

1,4-Dioxane

C4H8O2

HCID2734379

Pyridine-4-boronic acid

C5H6BNO2

结构：C[Si](C)(C)CCOCn1nc(I)c2ccc([N+](=O)[O-])cc21

HCID21877488

3-Iodo-6-nitro-1-{[2-(trimethylsilyl)ethoxy]methyl}-1H-indazole

C13H18IN3O3Si

结构：c1ccc([PH](c2ccccc2)(c2ccccc2)[Pd]([PH](c2ccccc2)(c2ccccc2)c2ccccc2)([PH](c2ccccc2)(c2ccccc2)c2ccccc2)[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID178420554

未命名化合物

PRODUCTS

生成物

结构：C[Si](C)(C)CCOCn1nc(-c2ccncc2)c2ccc([N+](=O)[O-])cc21

HCID68751669

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-df944d3519214325941809dc729be65e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[C:37](=[O:38])([O-:39])[O-:40].[CH2:31]1[O:32][CH2:33][CH2:34][O:35][CH2:36]1.[CH3:43][CH2:44][O:45][C:46]([CH3:47])=[O:48].[I:1][c:2]1[n:3][n:4]([CH2:14][O:15][CH2:16][CH2:17][Si:18]([CH3:19])([CH3:20])[CH3:21])[c:5]2[cH:6][c:7]([N+:11](=[O:12])[O-:13])[cH:8][cH:9][c:10]12.[Na+:41].[Na+:42].[OH2:49].[cH:50]1[cH:51][cH:52][c:53]([P:54]([Pd:55]([P:56]([c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)([c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)[c:69]2[cH:70][cH:71][cH:72][cH:73][cH:74]2)([P:75]([c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)([c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)[c:88]2[cH:89][cH:90][cH:91][cH:92][cH:93]2)[P:94]([c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)([c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)[c:107]2[cH:108][cH:109][cH:110][cH:111][cH:112]2)([c:113]2[cH:114][cH:115][cH:116][cH:117][cH:118]2)[c:119]2[cH:120][cH:121][cH:122][cH:123][cH:124]2)[cH:125][cH:126]1.[n:22]1[cH:23][cH:24][c:25]([B:28]([OH:29])[OH:30])[cH:26][cH:27]1>>[c:2]1(-[c:25]2[cH:24][cH:23][n:22][cH:27][cH:26]2)[n:3][n:4]([CH2:14][O:15][CH2:16][CH2:17][Si:18]([CH3:19])([CH3:20])[CH3:21])[c:5]2[cH:6][c:7]([N+:11](=[O:12])[O-:13])[cH:8][cH:9][c:10]12