HRID1211174

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID10928

Ethyl chloroformate

C3H5ClO2

HCID101016

4-Amino-2-methoxy-5-nitrobenzoic acid

C8H8N2O5

HCID415852

1-Benzyl-4-piperidinylamine

C12H18N2

PRODUCTS

生成物

结构：COc1cc(N)c([N+](=O)[O-])cc1C(=O)NC1CCN(Cc2ccccc2)CC1

HCID12821241

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b86a397e79184c278a8b3140a2cc2fcd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[CH2:29]([c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)[N:36]1[CH2:37][CH2:38][CH:39]([NH2:42])[CH2:40][CH2:41]1.[CH3:16][CH2:17][N:18]([CH2:19][CH3:20])[CH2:21][CH3:22].[CH3:1][O:2][c:3]1[c:4]([C:5](=[O:6])[OH:7])[cH:8][c:9]([N+:13](=[O:14])[O-:15])[c:10]([NH2:12])[cH:11]1.[CH3:43][N:44]([CH3:45])[CH:46]=[O:47].[Cl:23][C:24]([O:25][CH2:26][CH3:27])=[O:28]>>[CH3:1][O:2][c:3]1[c:4]([C:5](=[O:7])[NH:42][CH:39]2[CH2:38][CH2:37][N:36]([CH2:29][c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)[CH2:41][CH2:40]2)[cH:8][c:9]([N+:13](=[O:14])[O-:15])[c:10]([NH2:12])[cH:11]1