1-Pyrrolidineethanol → 4-[2-(2-Pyrrolidin-1-yl-ethoxy)-phenyl]-piperazine-1-carboxylic acid tert-butyl ester

반응식

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[c:15]([OH:20])[cH:16][cH:17][cH:18][cH:19]2)[CH2:12][CH2:13]1.[OH:21][CH2:22][CH2:23][N:24]1[CH2:25][CH2:26][CH2:27][CH2:28]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[c:15]([O:20][CH2:22][CH2:23][N:24]3[CH2:25][CH2:26][CH2:27][CH2:28]3)[cH:16][cH:17][cH:18][cH:19]2)[CH2:12][CH2:13]1

참가 물질

반응물 2

HCID 762881-Pyrrolidineethanol

HCID 11543684Tert-butyl 4-(2-hydroxyphenyl)piperazine-1-carboxylate

생성물 1

HCID 694221164-[2-(2-Pyrrolidin-1-yl-ethoxy)-phenyl]-piperazine-1-carboxylic acid tert-butyl ester

출처 및 근거

ORD 기록: ord-a5996518388849f9bf58a36181382016
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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