HRID97453

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID70048

Norcyclizine

C17H20N2

结构：COc1c2c(c(OC)c(OC)c1OC)CC(CCCCCCCCI)C2

HCID18348541

未命名化合物

PRODUCTS

生成物

结构：COc1c2c(c(OC)c(OC)c1OC)CC(CCCCCCCCN1CCN(C(c3ccccc3)c3ccccc3)CC1)C2

HCID18348628

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b5b27309582341189d8cad86f6dfbd59
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[C:46](=[O:47])([O-:48])[O-:49].[I:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH:10]1[CH2:11][c:12]2[c:13]([O:25][CH3:26])[c:14]([O:23][CH3:24])[c:15]([O:21][CH3:22])[c:16]([O:19][CH3:20])[c:17]2[CH2:18]1.[K+:50].[K+:51].[O:52]=[CH:53][N:54]([CH3:55])[CH3:56].[OH2:57].[c:27]1([CH:33]([N:34]2[CH2:35][CH2:36][NH:37][CH2:38][CH2:39]2)[c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[cH:28][cH:29][cH:30][cH:31][cH:32]1>>[CH2:2]([CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH:10]1[CH2:11][c:12]2[c:13]([O:25][CH3:26])[c:14]([O:23][CH3:24])[c:15]([O:21][CH3:22])[c:16]([O:19][CH3:20])[c:17]2[CH2:18]1)[N:37]1[CH2:36][CH2:35][N:34]([CH:33]([c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[CH2:39][CH2:38]1