HRID1125124

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID8028

Tetrahydrofuran

C4H8O

HCID519427

N-Benzyl-1-phenylethanamine

C15H17N

HCID53665462

未命名化合物

HCID178418339

未命名化合物

PRODUCTS

生成物

结构：CC(c1ccccc1)N(Cc1ccccc1)C(CC(=O)OC(C)(C)C)c1ccc(N)nc1

HCID70234412

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-825b2875600247cfb259a7aa1b3ba9a1
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

[C:22]([CH3:23])([CH3:24])([CH3:25])[O:26][C:27]([CH:28]=[CH:29][c:30]1[cH:31][n:32][c:33]([NH2:36])[cH:34][cH:35]1)=[O:37].[CH2:17]([Li:18])[CH2:19][CH2:20][CH3:21].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][CH:9]([c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1)[CH3:16].[CH2:40]1[O:41][CH2:42][CH2:43][CH2:44]1.[Cl-:38].[NH4+:39]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([CH:9]([c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1)[CH3:16])[CH:29]([CH2:28][C:27]([O:26][C:22]([CH3:23])([CH3:24])[CH3:25])=[O:37])[c:30]1[cH:31][n:32][c:33]([NH2:36])[cH:34][cH:35]1