HRID177722

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID813

Potassium cation

K+

2 次

HCID3776

Isopropanol

C3H8O

HCID15623

Heliamine

C11H15NO2

HCID19660

Carbonate Ion

CO3-2

HCID15285697

未命名化合物

PRODUCTS

产物

HCID15285680

6,7-Dimethoxy-2-[3-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]-2-hydroxy-1-propyl]1,2,3,4-tetrahydroisoquinoline

C26H32FN3O4

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-f6e8be6847a64b1f8b9a261c2eb9c2a5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应SMILES

[CH3:28][O:29][c:30]1[cH:31][c:32]2[c:37]([cH:38][c:39]1[O:40][CH3:41])[CH2:36][NH:35][CH2:34][CH2:33]2.[CH:42]([OH:43])([CH3:44])[CH3:45].[ClH:27].[K+:21].[K+:22].[O-:23][C:24]([O-:25])=[O:26].[O:1]1[CH:2]([CH2:3][N:4]2[CH2:5][CH2:6][CH:7]([c:10]3[n:11][o:12][c:13]4[c:14]3[cH:15][cH:16][c:17]([F:19])[cH:18]4)[CH2:8][CH2:9]2)[CH2:20]1>>[OH:1][CH:2]([CH2:3][N:4]1[CH2:5][CH2:6][CH:7]([c:10]2[n:11][o:12][c:13]3[c:14]2[cH:15][cH:16][c:17]([F:19])[cH:18]3)[CH2:8][CH2:9]1)[CH2:20][N:35]1[CH2:34][CH2:33][c:32]2[cH:31][c:30]([O:29][CH3:28])[c:39]([O:40][CH3:41])[cH:38][c:37]2[CH2:36]1