HRID2104717

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID996

Phenol

C6H6O

结构：OCc1cccc(-c2c(Cc3ccccc3)cnc3c(C(F)(F)F)cccc23)c1

HCID11223110

未命名化合物

HCID21904362

Methyl 5-hydroxy-1H-indole-2-carboxylate

C10H9NO3

PRODUCTS

生成物

结构：O=C(O)c1cc2cc(OCc3cccc(-c4c(Cc5ccccc5)cnc5c(C(F)(F)F)cccc45)c3)ccc2[nH]1

HCID66913706

未命名化合物

PROCEDURE

实验过程

The title compound was prepared using the procedure of example 69 using 5-Hydroxy-1H-indole-2-carboxylic acid methyl ester as the phenol and [3-(3-Benzyl-8-trifluoromethyl-quinolin-4-yl)-phenyl]-methanol as the alcohol. MS (ESI) m/z 553.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8b6f5f3c049e44218f604c6e0f2fb9b3
来源数据集: uspto-grants-2009_08
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07576215B2
来源说明: uspto-grants-2009_08

反应 SMILES

C[O:2][C:3]([C:5]1[NH:6][C:7]2[C:12]([CH:13]=1)=[CH:11][C:10]([OH:14])=[CH:9][CH:8]=2)=[O:4].C1(O)C=CC=CC=1.[CH2:22]([C:29]1[CH:30]=[N:31][C:32]2[C:37]([C:38]=1[C:39]1[CH:40]=[C:41]([CH2:45]O)[CH:42]=[CH:43][CH:44]=1)=[CH:36][CH:35]=[CH:34][C:33]=2[C:47]([F:50])([F:49])[F:48])[C:23]1[CH:28]=[CH:27][CH:26]=[CH:25][CH:24]=1>>[CH2:22]([C:29]1[CH:30]=[N:31][C:32]2[C:37]([C:38]=1[C:39]1[CH:40]=[C:41]([CH:42]=[CH:43][CH:44]=1)[CH2:45][O:14][C:10]1[CH:11]=[C:12]3[C:7](=[CH:8][CH:9]=1)[NH:6][C:5]([C:3]([OH:2])=[O:4])=[CH:13]3)=[CH:36][CH:35]=[CH:34][C:33]=2[C:47]([F:50])([F:49])[F:48])[C:23]1[CH:24]=[CH:25][CH:26]=[CH:27][CH:28]=1