HRID2319971

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID3280088

未命名化合物

HCID10801120

Methyl 4-(3-bromopropyl)benzoate

C11H13BrO2

结构：CC(C)(C)[Si](C)(C)OC(CCC1CCC(=O)N1)Cc1cccc(C(F)(F)F)c1

HCID12970098

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(CCCN2C(=O)CCC2CCC(Cc2cccc(C(F)(F)F)c2)O[Si](C)(C)C(C)(C)C)cc1

HCID12970099

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-09bf54a7a88a4bac8080a1f0bf8c97d1
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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