HRID1224227

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID813

Potassium cation

K+

HCID8028

Tetrahydrofuran

C4H8O

结构：CCOC(=O)CCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1

HCID500024

未命名化合物

结构：CC(C)(C)OC(=O)N1CCN(c2ccc(C=O)cc2)CC1

HCID2795509

1-Boc-4-(4-formylphenyl)piperazine

C16H22N2O3

HCID4574913

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)CCC=Cc1ccc(N2CCN(C(=O)OC(C)(C)C)CC2)cc1

HCID69161937

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ca2fd10df7494a9f9cab87ecb196b7ef
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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