HRID320393

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID614

DL-Proline

C5H9NO2

HCID813

Potassium cation

K+

3 次

HCID1061

Phosphate

O4P-3

HCID24350

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

CuI

HCID31275

1,4-Dioxane

C4H8O2

HCID88465

4-(Phenylmethoxy)-1H-indole

C15H13NO

HCID138835

1-Bromo-4-phenylmethoxybenzene

C13H11BrO

PRODUCTS

生成物

结构：c1ccc(COc2ccc(-n3ccc4c(OCc5ccccc5)cccc43)cc2)cc1

HCID59627922

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3f76a0b6bd2c4fc99adc4cc9fd8575e2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH2:49]1[O:50][CH2:51][CH2:52][O:53][CH2:54]1.[Cu:55][I:56].[K+:38].[K+:39].[K+:40].[OH:41][C:42]([CH:43]1[NH:44][CH2:45][CH2:46][CH2:47]1)=[O:48].[P:33]([O-:34])([O-:35])([O-:36])=[O:37].[c:18]1([CH2:24][O:25][c:26]2[cH:27][cH:28][c:29]([Br:32])[cH:30][cH:31]2)[cH:19][cH:20][cH:21][cH:22][cH:23]1.[c:1]1([CH2:7][O:8][c:9]2[c:10]3[cH:11][cH:12][nH:13][c:14]3[cH:15][cH:16][cH:17]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH2:7][O:8][c:9]2[c:10]3[cH:11][cH:12][n:13](-[c:29]4[cH:28][cH:27][c:26]([O:25][CH2:24][c:18]5[cH:19][cH:20][cH:21][cH:22][cH:23]5)[cH:31][cH:30]4)[c:14]3[cH:15][cH:16][cH:17]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1