Ethanol → 4-(6-chloro-3,4-dihydro-2H-benzo[1,4]oxazin-8-yl)-piperazine-1-carboxylic acid tert-butyl ester

반응식

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

참가 물질

반응물 2

HCID 702Ethanol

HCID 207656828-(4-Tert-butoxycarbonyl-piperazin-1-yl)-6-chloro-2,3-dihydro-benzo[1,4]oxazine-4-carboxylic acid benzyl ester

생성물 1

HCID 207656884-(6-chloro-3,4-dihydro-2H-benzo[1,4]oxazin-8-yl)-piperazine-1-carboxylic acid tert-butyl ester

출처 및 근거

ORD 기록: ord-5177573b369b4cd3a6606aeb2b5327c3
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

반응 노트

불러오는 중…