HRID109159

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID8471

Triethylamine

C6H15N

HCID13588

Cyclopent-2-en-1-one

C5H6O

HCID22636831

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：COCC1CN(c2ccc(C3CCC(=O)C3)cc2)C(=O)O1

HCID70049167

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f1355e722294445dad91b86140305fd3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[C:18]1(=[O:23])[CH:19]=[CH:20][CH2:21][CH2:22]1.[CH3:24][CH2:25][N:26]([CH2:27][CH3:28])[CH2:29][CH3:30].[ClH:17].[I:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[C:9](=[O:16])[O:10][CH:11]([CH2:13][O:14][CH3:15])[CH2:12]2)[cH:6][cH:7]1.[cH:31]1[cH:32][cH:33][c:34]([P:35]([Pd:36]([P:37]([c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)([c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)[c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)([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)([c:94]2[cH:95][cH:96][cH:97][cH:98][cH:99]2)[c:100]2[cH:101][cH:102][cH:103][cH:104][cH:105]2)[cH:106][cH:107]1>>[c:2]1([CH:20]2[CH2:19][C:18](=[O:23])[CH2:22][CH2:21]2)[cH:3][cH:4][c:5]([N:8]2[C:9](=[O:16])[O:10][CH:11]([CH2:13][O:14][CH3:15])[CH2:12]2)[cH:6][cH:7]1