HRID800499

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID20094333

1-Acetyl-5-(2-aminopropyl)-2,3-dihydro-1H-indole-7-carbonitrile

C14H17N3O

HCID20094335

1-(2-Bromoethoxy)-2-(2,2,2-trifluoroethoxy)benzene

C10H10BrF3O2

PRODUCTS

生成物

结构：CC(=O)N1CCc2cc(CC(C)NCCOc3ccccc3OCC(F)(F)F)cc(C#N)c21

HCID20094340

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ba2b527de5f8456f8cc261f966545119
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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