HRID816948

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID75994

1-Benzylpiperazine

C11H16N2

HCID498716

未命名化合物

结构：O=C1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C(Cc2ccccc2)C1

HCID11026356

未命名化合物

PRODUCTS

生成物

结构：O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC(N2CCN(Cc3ccccc3)CC2)CC1Cc1ccccc1

HCID18630815

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1550bd63c0794398980059329381ed11
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

[C:44]([BH3-:45])#[N:46].[CH3:48][CH2:49][OH:50].[Cl:51][CH2:52][Cl:53].[F:1][C:2]([c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH:9]([CH2:15][c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[CH2:10][C:11](=[O:14])[CH2:12][CH2:13]2)[cH:22][c:23]([C:25]([F:26])([F:27])[F:28])[cH:24]1)([F:29])[F:30].[Na+:47].[OH2:54].[c:31]1([CH2:37][N:38]2[CH2:39][CH2:40][NH:41][CH2:42][CH2:43]2)[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[F:1][C:2]([c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH:9]([CH2:15][c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[CH2:10][CH:11]([N:41]3[CH2:40][CH2:39][N:38]([CH2:37][c:31]4[cH:32][cH:33][cH:34][cH:35][cH:36]4)[CH2:43][CH2:42]3)[CH2:12][CH2:13]2)[cH:22][c:23]([C:25]([F:26])([F:27])[F:28])[cH:24]1)([F:29])[F:30]