HRID902804

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID67607

Benzoyl chloride, 4-(trifluoromethyl)-

C8H4ClF3O

HCID70136

4-(Chloromethyl)benzoyl chloride

C8H6Cl2O

HCID2760343

4-Phenoxybenzylamine

C13H13NO

HCID16770770

Methyl [4-(aminomethyl)phenoxy]acetate

C10H13NO3

PRODUCTS

生成物

结构：O=C(O)COc1ccc(CN(Cc2ccc(C(=O)NCc3ccc(Oc4ccccc4)cc3)cc2)C(=O)c2ccc(C(F)(F)F)cc2)cc1

HCID58693695

未命名化合物

PROCEDURE

实验过程

The title compound was prepared following the procedure A using 4-phenoxybenzylamine, 4-(chloromethyl)benzoyl chloride, 4-(trifluoromethyl)benzoyl chloride and methyl[4-(aminomethyl)phenoxy]acetate, acetate salt. M+(ESI): 669.2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0226fc86bff64b21bc35abff786073b1
来源数据集: uspto-grants-2008_04
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07365225B2
来源说明: uspto-grants-2008_04

反应 SMILES

[O:1]([C:8]1[CH:15]=[CH:14][C:11]([CH2:12][NH2:13])=[CH:10][CH:9]=1)[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1.Cl[CH2:17][C:18]1[CH:26]=[CH:25][C:21]([C:22](Cl)=[O:23])=[CH:20][CH:19]=1.[F:27][C:28]([F:39])([F:38])[C:29]1[CH:37]=[CH:36][C:32]([C:33](Cl)=[O:34])=[CH:31][CH:30]=1.C[O:41][C:42](=[O:53])[CH2:43][O:44][C:45]1[CH:50]=[CH:49][C:48]([CH2:51][NH2:52])=[CH:47][CH:46]=1>>[O:1]([C:8]1[CH:9]=[CH:10][C:11]([CH2:12][NH:13][C:22]([C:21]2[CH:25]=[CH:26][C:18]([CH2:17][N:52]([CH2:51][C:48]3[CH:49]=[CH:50][C:45]([O:44][CH2:43][C:42]([OH:53])=[O:41])=[CH:46][CH:47]=3)[C:33](=[O:34])[C:32]3[CH:36]=[CH:37][C:29]([C:28]([F:39])([F:38])[F:27])=[CH:30][CH:31]=3)=[CH:19][CH:20]=2)=[O:23])=[CH:14][CH:15]=1)[C:2]1[CH:3]=[CH:4][CH:5]=[CH:6][CH:7]=1