HRID2329354

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID1140

Toluene

C7H8

HCID7096

Phenylpiperazine

C10H14N2

HCID8058

n-Hexane

C6H14

HCID8471

Triethylamine

C6H15N

HCID10387

Benzyl chloroformate

C8H7ClO2

PRODUCTS

生成物

HCID9879254

1-Piperazinecarboxylic acid, 4-phenyl-, phenylmethyl ester

C18H20N2O2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-31df744b29c44a09bf7b189bc0c4f970
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

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