HRID105053

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

HCID28486

Lithium ion

Li+

结构：O=Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1

HCID618233

1-Tritylimidazole-4-carboxaldehyde

C23H18N2O

HCID5062348

未命名化合物

HCID7577838

N-Boc-2-piperidone

C10H17NO3

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCCC(C(O)c2cn(C(c3ccccc3)(c3ccccc3)c3ccccc3)cn2)C1=O

HCID22319455

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d27e94fb31d441c3884bc4e1b8a5a5ee
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

[C:23]([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)([c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)([c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1)[n:42]1[cH:43][n:44][c:45]([CH:47]=[O:48])[cH:46]1.[CH:1]([N-:2][CH:3]([CH3:4])[CH3:5])([CH3:6])[CH3:7].[Cl-:49].[Li+:8].[NH4+:50].[O:51]1[CH2:52][CH2:53][CH2:54][CH2:55]1.[O:9]=[C:10]1[N:11]([C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[CH2:12][CH2:13][CH2:14][CH2:15]1>>[O:9]=[C:10]1[N:11]([C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[CH2:12][CH2:13][CH2:14][CH:15]1[CH:47]([c:45]1[n:44][cH:43][n:42]([C:23]([c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)([c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[cH:46]1)[OH:48]