HRID820284

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID241

Benzene

C6H6

HCID702

Ethanol

C2H6O

HCID962

Water

H2O

HCID1118

Sulfuric acid

H2O4S

HCID9321

Hydrazine

H4N2

HCID12240

2-Methylhexan-2-ol

C7H16O

HCID345881

(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)acetonitrile

C10H6N2O2

结构：CCCCC(C)(C)NC(=O)CN1C(=O)c2ccccc2C1=O

HCID23454152

未命名化合物

PRODUCTS

生成物

HCID23454138

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-377510edd393448793bb7fae2ee4fb06
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1]1(=[O:2])[N:3]([CH2:4][C:5]#[N:6])[C:7](=[O:8])[c:9]2[cH:10][cH:11][cH:12][cH:13][c:14]21.[CH3:15][C:16]([OH:17])([CH2:18][CH2:19][CH2:20][CH3:21])[CH3:22].[CH3:28][C:29]([CH2:30][CH2:31][CH2:32][CH3:33])([CH3:34])[NH:35][C:36]([CH2:37][N:38]1[C:39](=[O:40])[c:41]2[cH:42][cH:43][cH:44][cH:45][c:46]2[C:47]1=[O:48])=[O:49].[CH3:53][C:54](=[O:55])[OH:56].[CH3:57][CH2:58][OH:59].[NH2:51][NH2:52].[OH2:50].[S:23](=[O:24])(=[O:25])([OH:26])[OH:27].[cH:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1>>[CH3:28][C:29]([CH2:30][CH2:31][CH2:32][CH3:33])([CH3:34])[NH:35][C:36]([CH2:37][NH2:38])=[O:49]