HRID139361

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3283

Diethyl Ether

C4H10O

HCID7701

4-Dodecylaniline

C18H31N

HCID8471

Triethylamine

C6H15N

HCID67672

2-Chloro-4'-fluoropropiophenone

C9H8ClFO

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

结构：CCCCCCCCCCCCc1ccc(NCCC(=O)c2ccc(F)cc2)cc1

HCID15085636

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3d05ab176da84bba88ecec5118e9592a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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