HRID808155

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID702

Ethanol

C2H6O

HCID3776

Isopropanol

C3H8O

结构：C=C(C)n1c(=O)n(CC(C)CN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)c2ccccc21

HCID20506308

未命名化合物

PRODUCTS

生成物

结构：CC(CN1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)CC1)Cn1c(=O)[nH]c2ccccc21

HCID13105603

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-814c36f6e7584205b24e2eec7e61ea47
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:39][CH2:40][OH:41].[CH3:43][CH:44]([OH:45])[CH3:46].[ClH:42].[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([N:9]2[CH2:10][CH2:11][N:12]([CH2:15][CH:16]([CH2:17][n:18]3[c:19](=[O:30])[n:20]([C:27]([CH3:28])=[CH2:29])[c:21]4[c:22]3[cH:23][cH:24][cH:25][cH:26]4)[CH3:31])[CH2:13][CH2:14]2)[c:32]2[cH:33][cH:34][c:35]([F:38])[cH:36][cH:37]2)[cH:6][cH:7]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([N:9]2[CH2:10][CH2:11][N:12]([CH2:15][CH:16]([CH2:17][n:18]3[c:19](=[O:30])[nH:20][c:21]4[c:22]3[cH:23][cH:24][cH:25][cH:26]4)[CH3:31])[CH2:13][CH2:14]2)[c:32]2[cH:33][cH:34][c:35]([F:38])[cH:36][cH:37]2)[cH:6][cH:7]1