HRID292844

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID222

Ammonia gas

H3N

HCID312

Chloride

Cl-

HCID679

Dimethyl sulfoxide

C2H6OS

HCID8857

Ethyl acetate

C4H8O2

HCID28486

Lithium ion

Li+

HCID62652

未命名化合物

HCID78786

2-Bromo-6-methoxynaphthalene

C11H9BrO

结构：CCC[CH2][Sn]([CH2]CCC)([CH2]CCC)[c]1ccc(OC)cc1[N+](=O)[O-]

HCID23087474

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(-c2ccc3cc(OC)ccc3c2)c([N+](=O)[O-])c1

HCID23087556

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-aab959ba45c5421db14efc7c0f7cee6d
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

[CH2:14]([Sn:15]([CH2:16][CH2:17][CH2:18][CH3:30])([c:19]1[c:20]([N+:27](=[O:28])[O-:29])[cH:21][c:22]([O:25][CH3:26])[cH:23][cH:24]1)[CH2:31][CH2:32][CH2:33][CH3:34])[CH2:35][CH2:36][CH3:37].[CH3:124][CH2:125][O:126][C:127](=[O:128])[CH3:129].[CH3:1][O:2][c:3]1[cH:4][c:5]2[cH:6][cH:7][c:8]([Br:13])[cH:9][c:10]2[cH:11][cH:12]1.[CH3:41][S:42]([CH3:43])=[O:44].[Cl-:39].[Cl:122][Cu:123].[Li+:38].[NH3:40].[cH:45]1[cH:46][cH:47][c:48]([P:49]([Pd:50]([P:51]([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)[c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)([P:70]([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)[c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[P:89]([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)[c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)[cH:120][cH:121]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[cH:6][cH:7][c:8](-[c:19]3[c:20]([N+:27](=[O:28])[O-:29])[cH:21][c:22]([O:25][CH3:26])[cH:23][cH:24]3)[cH:9][c:10]2[cH:11][cH:12]1