HRID941442

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID1140

Toluene

C7H8

HCID7947

1,3,5-Trimethylbenzene

C9H12

HCID70151

Dipiperidinomethane

C11H22N2

结构：CCCCCCOc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c(O)c1

HCID4992761

2-(4,6-Diphenyl-s-triazin-2-yl)-5-hexyloxyphenol

C27H27N3O2

PRODUCTS

生成物

结构：CCCCCCOc1cc(O)c(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1CN1CCCCC1

HCID135811192

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2a271d8b5cbe4ec4a7f4780a0cd0a062
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:48][C:49](=[O:50])[OH:51].[CH3:61][c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1.[N:33]1([CH2:39][N:40]2[CH2:41][CH2:42][CH2:43][CH2:44][CH2:45]2)[CH2:34][CH2:35][CH2:36][CH2:37][CH2:38]1.[Na+:47].[OH-:46].[c:1]1(-[c:7]2[n:8][c:9](-[c:19]3[c:20]([OH:32])[cH:21][c:22]([O:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH3:31])[cH:23][cH:24]3)[n:10][c:11](-[c:13]3[cH:14][cH:15][cH:16][cH:17][cH:18]3)[n:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[c:52]1([CH3:53])[cH:54][c:55]([CH3:56])[cH:57][c:58]([CH3:59])[cH:60]1>>[c:1]1(-[c:7]2[n:8][c:9](-[c:19]3[c:20]([OH:32])[cH:21][c:22]([O:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH3:31])[c:23]([CH2:39][N:33]4[CH2:34][CH2:35][CH2:36][CH2:37][CH2:38]4)[cH:24]3)[n:10][c:11](-[c:13]3[cH:14][cH:15][cH:16][cH:17][cH:18]3)[n:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1