HRID145780

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID15908

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

C8H17N3

HCID79334

3-tert-Butylaniline

C10H15N

HCID19063864

4-[4-(Ethoxycarbonyl)piperidin-1-yl]benzoic acid

C15H19NO4

PRODUCTS

生成物

结构：CCOC(=O)C1CCN(c2ccc(C(=O)Nc3cccc(C(C)(C)C)c3)cc2)CC1

HCID59318053

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-94f0a2c063de4d8aa531b64e695364eb
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

[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([NH2:8])[cH:9][cH:10][cH:11]1.[CH2:12]([CH3:13])[O:14][C:15](=[O:16])[CH:17]1[CH2:18][CH2:19][N:20]([c:23]2[cH:24][cH:25][c:26]([C:29](=[O:30])[OH:31])[cH:27][cH:28]2)[CH2:21][CH2:22]1.[CH3:32][CH2:33][N:34]=[C:35]=[N:36][CH2:37][CH2:38][CH2:39][N:40]([CH3:41])[CH3:42].[Cl:43][CH2:44][Cl:45]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([NH:8][C:29]([c:26]2[cH:25][cH:24][c:23]([N:20]3[CH2:19][CH2:18][CH:17]([C:15]([O:14][CH2:12][CH3:13])=[O:16])[CH2:22][CH2:21]3)[cH:28][cH:27]2)=[O:30])[cH:9][cH:10][cH:11]1