HRID191997

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID24290

未命名化合物

HCID83717

Copper iodide (CuI2)

CuI2

HCID11380407

Methyl 4-iodosalicylate

C8H7IO3

HCID22592634

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(C#CCc2cccc3c2OCCC3(C)C)cc1O

HCID22592613

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ddff805845b24e80bcd11149964c690b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH3:1][C:2]1([CH3:15])[CH2:3][CH2:4][O:5][c:6]2[c:7]([CH2:12][C:13]#[CH:14])[cH:8][cH:9][cH:10][c:11]21.[CH3:72][CH2:73][N:74]([CH2:75][CH3:76])[CH2:77][CH3:78].[Cu:69]([I:70])[I:71].[OH:16][c:17]1[c:18]([C:19](=[O:20])[O:21][CH3:22])[cH:23][cH:24][c:25]([I:27])[cH:26]1.[Pd:28]([Cl:29])[Cl:30].[c:31]1([P:32]([c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[cH:45][cH:46][cH:47][cH:48][cH:49]1.[c:50]1([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)[cH:64][cH:65][cH:66][cH:67][cH:68]1>>[CH3:1][C:2]1([CH3:15])[CH2:3][CH2:4][O:5][c:6]2[c:7]([CH2:12][C:13]#[C:14][c:25]3[cH:24][cH:23][c:18]([C:19](=[O:20])[O:21][CH3:22])[c:17]([OH:16])[cH:26]3)[cH:8][cH:9][cH:10][c:11]21