HRID954388

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID9255

Oxazole

C3H3NO

HCID11776

Triphenylphosphine

C18H15P

4 次

HCID23938

Palladium

HCID32051

Zinc (II) cation

Zn+2

HCID21086165

未命名化合物

HCID178418339

未命名化合物

PRODUCTS

生成物

结构：CCCCN(C)C(=O)c1cc(C(=O)OC)cc(-c2ncco2)c1

HCID21086164

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-897081755b3444e399e48efaca961c9f
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

[CH2:11]([CH2:12][CH2:13][CH3:14])[N:15]([C:16](=[O:17])[c:18]1[cH:19][c:20]([C:21](=[O:22])[O:23][CH3:24])[cH:25][c:26]([I:28])[cH:27]1)[CH3:29].[CH2:6]([Li:7])[CH2:8][CH2:9][CH3:10].[CH3:35][CH2:36][O:37][C:38](=[O:39])[CH3:40].[Cl-:41].[Cl-:43].[O:30]1[CH2:31][CH2:32][CH2:33][CH2:34]1.[Pd:120].[Zn+2:42].[c:101]1([P:102]([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)[cH:115][cH:116][cH:117][cH:118][cH:119]1.[c:44]1([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)[cH:58][cH:59][cH:60][cH:61][cH:62]1.[c:63]1([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)[cH:77][cH:78][cH:79][cH:80][cH:81]1.[c:82]1([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)[cH:96][cH:97][cH:98][cH:99][cH:100]1.[o:1]1[cH:2][n:3][cH:4][cH:5]1>>[o:1]1[c:2](-[c:26]2[cH:25][c:20]([C:21](=[O:22])[O:23][CH3:24])[cH:19][c:18]([C:16]([N:15]([CH2:11][CH2:12][CH2:13][CH3:14])[CH3:29])=[O:17])[cH:27]2)[n:3][cH:4][cH:5]1