HRID2125529

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID19660

Carbonate

CO3-2

HCID201262

Benzeneboronic acid, p-methoxy-

C7H9BO3

结构：Cc1cc(Br)n(-c2ccc([N+](=O)[O-])cc2)n1

HCID11482930

未命名化合物

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：COc1ccc(-c2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)cc1

HCID15505640

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-64fde1817aaf4db998194246203efee6
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

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