HRID834945

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID10773455

2-(dimethylamino)benzyl chloride

C9H12ClN

结构：CC(C)c1ccc(N(Cc2cn[nH]c2)C(=O)C2CCCc3c(OCc4ccccc4)cccc32)cn1

HCID59597432

未命名化合物

PRODUCTS

生成物

结构：CC(C)c1ccc(N(Cc2cnn(Cc3ccccc3N(C)C)c2)C(=O)C2CCCc3c(OCc4ccccc4)cccc32)cn1

HCID59597266

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2d2d83c89efc404d8798fb16ce19100b
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

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