HRID182331

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID21885

2-Dimethylaminopyridine

C7H10N2

HCID69118

Benzoic acid, 2-(dimethylamino)-

C9H11NO2

HCID78461

1-Benzylpiperidin-4-ol

C12H17NO

PRODUCTS

生成物

结构：CN(C)c1ccccc1C(=O)OC1CCN(Cc2ccccc2)CC1

HCID18919776

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-68f6476fd77546f39c61299ecfe49e0b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH2:22]([c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1)[N:29]1[CH2:30][CH2:31][CH:32]([OH:35])[CH2:33][CH2:34]1.[CH2:37]([N:38]=[C:39]=[N:40][CH2:41][CH2:42][CH2:43][N:44]([CH3:45])[CH3:46])[CH3:47].[CH3:13][N:14]([c:15]1[cH:16][cH:17][cH:18][cH:19][n:20]1)[CH3:21].[CH3:1][N:2]([c:3]1[c:4]([C:5](=[O:6])[OH:7])[cH:8][cH:9][cH:10][cH:11]1)[CH3:12].[CH3:48][N:49]([CH3:50])[CH:51]=[O:52].[ClH:36]>>[CH3:1][N:2]([c:3]1[c:4]([C:5](=[O:6])[O:7][CH:32]2[CH2:31][CH2:30][N:29]([CH2:22][c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[CH2:34][CH2:33]2)[cH:8][cH:9][cH:10][cH:11]1)[CH3:12]