HRID97485

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

结构：CC(C)(C(=O)O)c1ccc(C(O)CCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1

HCID3348

Fexofenadine

C32H39NO4

HCID7914

Isopropyl ether

C6H14O

HCID15413

Methyl tert-butyl ether

C5H12O

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

HCID3348

Fexofenadine

C32H39NO4

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6a7acce34796495283824c1e50125024
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

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