HRID198273

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID887

Methanol

CH4O

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8900

Heptane

C7H16

HCID3028194

Lithium

HCID5306152

1-Acetamido-3-chloropropan-2-yl acetate

C7H12ClNO3

HCID15908281

未命名化合物

PRODUCTS

生成物

HCID21585220

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cc906e42261b4c36912a78049868c218
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

[C:16](=[O:18])([O:19][CH:20]([CH2:21][NH:22][C:23]([CH3:24])=[O:25])[CH2:26][Cl:17])[CH3:27].[CH3:1][CH:2]([CH3:3])[CH2:4][O:5][C:14]([NH:6][c:7]1[cH:8][c:9]([F:13])[cH:10][cH:11][cH:12]1)=[O:15].[CH3:28][OH:29].[CH3:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH3:39].[CH3:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1.[CH3:48][N:49]([CH3:50])[CH:51]=[O:52].[Cl-:31].[Li:30].[NH4+:32].[OH2:47]>>[N:6]1([c:7]2[cH:8][c:9]([F:13])[cH:10][cH:11][cH:12]2)[C:16](=[O:18])[O:19][CH:20]([CH2:21][NH:22][C:23]([CH3:24])=[O:25])[CH2:26]1