HRID124624

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID769

Bicarbonate Ion

CHO3-

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID4077791

3-{[tert-Butyl(dimethyl)silyl]oxy}propan-1-ol

C9H22O2Si

结构：Nc1ccc2cc(-c3ccccc3C(F)(F)F)[nH]c(=O)c2c1

HCID23156738

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)[Si](C)(C)OCCCNc1ccc2cc(-c3ccccc3C(F)(F)F)[nH]c(=O)c2c1

HCID57558101

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-53d77a859cc64bc6bb8b308d5bd7f3d7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[C:23]([CH3:24])([CH3:25])([CH3:26])[Si:27]([O:28][CH2:29][CH2:30][CH2:31][OH:32])([CH3:33])[CH3:34].[C:39](=[O:40])([OH:41])[O-:42].[CH3:35][C:36](=[O:37])[OH:38].[CH3:44][OH:45].[NH2:1][c:2]1[cH:3][cH:4][c:5]2[cH:6][c:7](-[c:13]3[c:14]([C:19]([F:20])([F:21])[F:22])[cH:15][cH:16][cH:17][cH:18]3)[nH:8][c:9](=[O:12])[c:10]2[cH:11]1.[Na+:43]>>[NH:1]([c:2]1[cH:3][cH:4][c:5]2[cH:6][c:7](-[c:13]3[c:14]([C:19]([F:20])([F:21])[F:22])[cH:15][cH:16][cH:17][cH:18]3)[nH:8][c:9](=[O:12])[c:10]2[cH:11]1)[CH2:31][CH2:30][CH2:29][O:28][Si:27]([C:23]([CH3:24])([CH3:25])[CH3:26])([CH3:33])[CH3:34]