HRID945065

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID923

Sodium ion

Na+

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl Acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID53402948

5-Bromo-2-nitrothiophene-3-carboxamide

C5H3BrN2O3S

反应SMILES：CC1(C)OB(c2ccc(C3(O)COC3)cc2)OC1(C)C

HCID58382247

未命名化合物

反应SMILES：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

产物

反应SMILES：NC(=O)c1cc(-c2ccc(C3(O)COC3)cc2)sc1[N+](=O)[O-]

HCID59526292

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-bd2631c53ed94a3eb84b75467619af50
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应SMILES

[Br:1][c:2]1[cH:3][c:4]([C:10](=[O:11])[NH2:12])[c:5]([N+:7](=[O:8])[O-:9])[s:6]1.[C:33](=[O:34])([O-:35])[O-:36].[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[CH3:123][CH2:124][O:125][C:126]([CH3:127])=[O:128].[CH3:13][C:14]1([CH3:15])[C:16]([CH3:17])([CH3:18])[O:19][B:20]([c:21]2[cH:22][cH:23][c:24]([C:27]3([OH:31])[CH2:28][O:29][CH2:30]3)[cH:25][cH:26]2)[O:32]1.[Cl-:39].[NH4+:40].[Na+:37].[Na+:38].[cH:46]1[cH:47][cH:48][c:49]([P:50]([Pd:51]([P:52]([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)([P:71]([c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)([c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)[c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)[P:90]([c:91]2[cH:92][cH:93][cH:94][cH:95][cH:96]2)([c:97]2[cH:98][cH:99][cH:100][cH:101][cH:102]2)[c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)([c:109]2[cH:110][cH:111][cH:112][cH:113][cH:114]2)[c:115]2[cH:116][cH:117][cH:118][cH:119][cH:120]2)[cH:121][cH:122]1>>[c:2]1(-[c:21]2[cH:22][cH:23][c:24]([C:27]3([OH:31])[CH2:28][O:29][CH2:30]3)[cH:25][cH:26]2)[cH:3][c:4]([C:10](=[O:11])[NH2:12])[c:5]([N+:7](=[O:8])[O-:9])[s:6]1