HRID179255

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID16028

Tetrabutylammonium

C16H36N+

HCID23061538

5-Ethenylpyridine-2-carboxylic acid

C8H7NO2

HCID68560092

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc2c(c1)c1c(n2CCc2ccc(C(=O)O)nc2)CCN(C)CC1

HCID59368169

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-140d5c85df164ea493df42dc5ff69e5a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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