HRID2130789

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID813

Potassium cation

K+

HCID1140

Toluene

C7H8

HCID30165

Iodide ion

I-

HCID3280088

未命名化合物

结构：CN(C)CCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1

HCID4186543

Phosphonium, [3-(dimethylamino)propyl]triphenyl-

C23H27NP+

HCID11690056

未命名化合物

PRODUCTS

生成物

结构：COC(=O)Cc1ccc(OCc2ccccc2C=CCCN(C)C)c(I)c1

HCID68911643

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-27f1c37f627d4382b946217526d305bd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[CH3:12][N:13]([CH2:14][CH2:15][CH2:16][P+:17]([c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1)([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)[c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)[CH3:36].[CH3:1][Si:2]([N-:3][Si:4]([CH3:5])([CH3:6])[CH3:7])([CH3:8])[CH3:9].[CH3:37][O:38][C:39]([CH2:40][c:41]1[cH:42][c:43]([I:57])[c:44]([O:47][CH2:48][c:49]2[c:50]([CH:55]=[O:56])[cH:51][cH:52][cH:53][cH:54]2)[cH:45][cH:46]1)=[O:58].[CH3:60][c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1.[ClH:59].[I-:11].[K+:10]>>[CH3:12][N:13]([CH2:14][CH2:15][CH:16]=[CH:55][c:50]1[c:49]([CH2:48][O:47][c:44]2[c:43]([I:57])[cH:42][c:41]([CH2:40][C:39]([O:38][CH3:37])=[O:58])[cH:46][cH:45]2)[cH:54][cH:53][cH:52][cH:51]1)[CH3:36]