HRID951530

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID180

Acetone

C3H6O

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID19660

Carbonate Ion

CO3-2

HCID10797767

5-dimethylamino-2,3,4,5-tetrahydro-1H-benzoazepine

C12H18N2

HCID18917320

4-[2-(2-Chloro-phenyl)acetylamino]benzoyl chloride

C15H11Cl2NO2

PRODUCTS

产物

HCID18917288

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-a3d1b29080cf455b95c23c4d6037bcd2
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应SMILES

[C:1](=[O:2])([O-:3])[O-:4].[CH3:41][C:42](=[O:43])[CH3:44].[CH3:7][N:8]([CH:9]1[CH2:10][CH2:11][CH2:12][NH:13][c:14]2[c:15]1[cH:16][cH:17][cH:18][cH:19]2)[CH3:20].[Cl:21][c:22]1[c:23]([CH2:28][C:29](=[O:30])[NH:31][c:32]2[cH:33][cH:34][c:35]([C:36](=[O:37])[Cl:38])[cH:39][cH:40]2)[cH:24][cH:25][cH:26][cH:27]1.[K+:5].[K+:6].[OH2:45]>>[CH3:7][N:8]([CH:9]1[CH2:10][CH2:11][CH2:12][N:13]([C:36]([c:35]2[cH:34][cH:33][c:32]([NH:31][C:29]([CH2:28][c:23]3[c:22]([Cl:21])[cH:27][cH:26][cH:25][cH:24]3)=[O:30])[cH:40][cH:39]2)=[O:37])[c:14]2[c:15]1[cH:16][cH:17][cH:18][cH:19]2)[CH3:20]