HRID2132313

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID15623

Heliamine

C11H15NO2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID4330521

2-(4-methoxy-3-nitrophenyl)acetic acid

C9H9NO5

PRODUCTS

生成物

结构：COc1cc2c(cc1OC)CN(C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1)CC2

HCID19974482

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3f6ccee45bff45479c44ca80c441abf1
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[CH3:1][O:2][c:3]1[c:4]([N+:13](=[O:14])[O-:15])[cH:5][c:6]([CH2:9][C:10](=[O:11])[OH:12])[cH:7][cH:8]1.[CH3:26][O:27][c:28]1[cH:29][c:30]2[c:35]([cH:36][c:37]1[O:38][CH3:39])[CH2:34][NH:33][CH2:32][CH2:31]2.[CH:40]1([N:41]=[C:42]=[N:43][CH:44]2[CH2:45][CH2:46][CH2:47][CH2:48][CH2:49]2)[CH2:50][CH2:51][CH2:52][CH2:53][CH2:54]1.[O:55]=[CH:56][N:57]([CH3:58])[CH3:59].[OH:16][n:17]1[c:18]2[cH:19][cH:20][cH:21][cH:22][c:23]2[n:24][n:25]1>>[CH3:1][O:2][c:3]1[c:4]([N+:13](=[O:14])[O-:15])[cH:5][c:6]([CH2:9][C:10](=[O:12])[N:33]2[CH2:32][CH2:31][c:30]3[cH:29][c:28]([O:27][CH3:26])[c:37]([O:38][CH3:39])[cH:36][c:35]3[CH2:34]2)[cH:7][cH:8]1