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Acetic Acid → (2-(1-(2-Cyano-4-trifluoromethylphenyl)piperidin-4-ylamino)-ethyl)carbamic acid tert-butyl ester

HRID 215367
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인쇄 미리보기

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HRID 215367 반응식
[C:1](#[N:2])[c:3]1[c:4]([N:13]2[CH2:14][CH2:15][C:16](=[O:19])[CH2:17][CH2:18]2)[cH:5][cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1.[C:35]([BH3-:36])#[N:37].[CH3:31][C:32](=[O:33])[OH:34].[NH2:20][CH2:21][CH2:22][NH:23][C:24]([O:25][C:26]([CH3:27])([CH3:28])[CH3:29])=[O:30].[Na+:38]>>[C:1](#[N:2])[c:3]1[c:4]([N:13]2[CH2:14][CH2:15][CH:16]([NH:20][CH2:21][CH2:22][NH:23][C:24]([O:25][C:26]([CH3:27])([CH3:28])[CH3:29])=[O:30])[CH2:17][CH2:18]2)[cH:5][cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1
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6

반응물 5

HCID 176Acetic AcidHCID 923Sodium IonHCID 187201N-BOC-ethylenediamineHCID 498716Cyano-borohydrideHCID 22615393N-(2-Cyano-4-trifluoromethylphenyl)-4-piperidone

생성물 1

HCID 18727097(2-(1-(2-Cyano-4-trifluoromethylphenyl)piperidin-4-ylamino)-ethyl)carbamic acid tert-butyl ester

출처 및 근거

ORD 기록
ord-ecb1200bd93a4513b43081e0572272aa
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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