HRID293011

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

HCID92911

Quinoline, decahydro-

C9H17N

HCID86630058

未命名化合物

PRODUCTS

生成物

结构：[N-]=[N+]=NCCn1cnc2cc(C(=O)N3CCCC4CCCCC43)ccc21

HCID86630061

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1cd9890b2c6747e8ae95ebef15d20123
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

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