HRID1127065

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

结构：COC(=O)C(c1ccccc1)N1CCC(c2ccc(NC(=O)c3ccccc3-c3ccc(C(F)(F)F)cc3)cc2)CC1

HCID17989467

Methyl α-phenyl-4-[4-[[[4′-(trifluoromethyl)[1,1′-biphenyl]-2-yl]carbonyl]amino]phenyl]-1-piperidineacetate

C34H31F3N2O3

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

结构：O=C(Nc1ccc(C2CCN(C(C(=O)O)c3ccccc3)CC2)cc1)c1ccccc1-c1ccc(C(F)(F)F)cc1

HCID22499383

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5c242b9b31a249c284d507f8ea2e36bc
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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