HRID811268

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID702

Ethanol

C2H6O

HCID787

Hydroxylamine

H3NO

HCID813

Potassium cation

K+

HCID961

Hydroxide

HO-

HCID1049

Pyridine

C5H5N

结构：Cc1nc2n(c(=O)c1CCN1CCC(C(=O)c3ccc(F)cc3F)CC1)CCCC2

HCID29941101

DES(6-fluoro-1,2-benzoxazole)-2,4-difluorobenzoyl risperidone

C23H27F2N3O2

PRODUCTS

生成物

结构：Cc1nc2n(c(=O)c1CCN1CCC(C(=NO)c3ccc(F)cc3F)CC1)CCCC2

HCID71433889

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a64a30e4d43a4dbd981d38e9c7730733
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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