HRID114727

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID6212

Chloroform

CHCl3

HCID8065

2-Butene-1,4-diol

C4H8O2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID105282

Benzoyl chloride, 4-(hexadecylamino)-

C23H38ClNO

PRODUCTS

生成物

结构：CCCCCCCCCCCCCCCCNc1ccc(C(=O)OCC=CCO)cc1

HCID53942674

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5746c060996e484dae1c97c073a94e38
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

[CH2:8]([CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH3:23])[NH:24][c:25]1[cH:26][cH:27][c:28]([C:29](=[O:30])[Cl:31])[cH:32][cH:33]1.[CH3:38][N:39]([CH3:40])[c:41]1[cH:42][cH:43][n:44][cH:45][cH:46]1.[CH:34]([Cl:35])([Cl:36])[Cl:37].[ClH:7].[OH2:47].[OH:1][CH2:2][CH:3]=[CH:4][CH2:5][OH:6]>>[O:1]([CH2:2][CH:3]=[CH:4][CH2:5][OH:6])[C:29]([c:28]1[cH:27][cH:26][c:25]([NH:24][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH3:23])[cH:33][cH:32]1)=[O:30]