HRID304437

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID15908

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

C8H17N3

HCID66677

2,3-Diphenyl-2-propenoic acid

C15H12O2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID11084159

Methyl 7-aminoheptanoate

C8H17NO2

PRODUCTS

生成物

结构：COC(=O)CCCCCCNC(=O)C(=Cc1ccccc1)c1ccccc1

HCID68495211

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1a62a7ab8b6e437794f5dc39f7d866be
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH3:18][O:19][C:20]([CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][NH2:27])=[O:28].[CH3:29][CH2:30][N:31]=[C:32]=[N:33][CH2:34][CH2:35][CH2:36][N:37]([CH3:38])[CH3:39].[O:50]=[CH:51][N:52]([CH3:53])[CH3:54].[OH2:55].[OH:40][n:41]1[c:42]2[c:43]([cH:44][cH:45][cH:46][cH:47]2)[n:48][n:49]1.[c:1]1([C:7]([C:8](=[O:9])[OH:10])=[CH:11][c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7]([C:8](=[O:10])[NH:27][CH2:26][CH2:25][CH2:24][CH2:23][CH2:22][CH2:21][C:20]([O:19][CH3:18])=[O:28])=[CH:11][c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1