HRID198492

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID949

N,N-Dimethylaniline

C8H11N

HCID1049

Pyridine

C5H5N

HCID6371

Phosgene

CCl2O

HCID7738

(4-Methoxyphenyl)methanol

C8H10O2

HCID69998

Benzeneacetonitrile, .alpha.-(hydroxyimino)-

C8H6N2O

HCID53654775

未命名化合物

PRODUCTS

生成物

HCID3916227

2-(4-Methoxybenzyloxycarbonyloxyimino)-2-phenylacetonitrile

C17H14N2O4

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3bf7fe3fc69f4b29b2ebfe808f2b239e
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

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