HRID93993

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID31738

4-Benzylpiperidine

C12H17N

结构：O=C(O)c1ccc(Cc2ccccc2)c(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1

HCID86595538

未命名化合物

PRODUCTS

生成物

结构：O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(C(=O)N2CCC(Cc3ccccc3)CC2)ccc1Cc1ccccc1

HCID17860186

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6c9d9c2c52cb4c4a9ebd3aabf47c4ab4
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

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