Trifluoroacetic acid → Benzoic acid [1,4']bipiperidinyl-4-yl ester

HRID 124073

반응식

HRID 124073 반응식
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH2:10][CH:11]([N:14]2[CH2:15][CH2:16][CH:17]([O:20][C:21]([c:22]3[cH:23][cH:24][cH:25][cH:26][cH:27]3)=[O:28])[CH2:18][CH2:19]2)[CH2:12][CH2:13]1)([CH3:5])([CH3:6])[CH3:7].[OH:29][C:30]([C:31]([F:32])([F:33])[F:34])=[O:35]>>[NH:8]1[CH2:9][CH2:10][CH:11]([N:14]2[CH2:15][CH2:16][CH:17]([O:20][C:21]([c:22]3[cH:23][cH:24][cH:25][cH:26][cH:27]3)=[O:28])[CH2:18][CH2:19]2)[CH2:12][CH2:13]1

참가 물질

3

반응물 2

HCID 6422Trifluoroacetic acidHCID 669016764-Benzoyloxy-[1,4']bipiperidinyl-1'-carboxylic acid tert-butyl ester

생성물 1

HCID 66901535Benzoic acid [1,4']bipiperidinyl-4-yl ester

출처 및 근거

ORD 기록
ord-8c200570eeec42979bf61358a9bdc679
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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