HRID838657

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID24350

Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

CuI

HCID18761561

Ethyl 2-fluoro-4-iodobenzoate

C9H8FIO2

HCID18931462

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1ccc(C#Cc2ccc3c(c2)N(c2ccc(C)cc2)CCC3(C)C)cc1F

HCID18931465

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d83f2ff44e1b4e6b8096cce9e68265e5
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH2:42]([Cl:43])[Cl:44].[CH3:1][C:2]1([CH3:21])[CH2:3][CH2:4][N:5]([c:14]2[cH:15][cH:16][c:17]([CH3:20])[cH:18][cH:19]2)[c:6]2[cH:7][c:8]([C:12]#[CH:13])[cH:9][cH:10][c:11]21.[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[CH3:47][CH2:48][O:49][C:50](=[O:51])[CH3:52].[Cu:45][I:46].[F:22][c:23]1[c:24]([C:25](=[O:26])[O:27][CH2:28][CH3:29])[cH:30][cH:31][c:32]([I:34])[cH:33]1>>[CH3:1][C:2]1([CH3:21])[CH2:3][CH2:4][N:5]([c:14]2[cH:15][cH:16][c:17]([CH3:20])[cH:18][cH:19]2)[c:6]2[cH:7][c:8]([C:12]#[C:13][c:32]3[cH:31][cH:30][c:24]([C:25](=[O:26])[O:27][CH2:28][CH3:29])[c:23]([F:22])[cH:33]3)[cH:9][cH:10][c:11]21