Tetrahydrofuran → Ethyl 4-(2-chloro-5-(trifluoromethyl)benzamido)-2-methylcyclohexane carboxylate

반응식

[CH2:28]1[O:29][CH2:30][CH2:31][CH2:32]1.[Cl:14][c:15]1[c:16]([C:17](=[O:18])[Cl:19])[cH:20][c:21]([C:24]([F:25])([F:26])[F:27])[cH:22][cH:23]1.[NH2:1][CH:2]1[CH2:3][CH:4]([CH3:13])[CH:5]([C:8](=[O:9])[O:10][CH2:11][CH3:12])[CH2:6][CH2:7]1>>[NH:1]([CH:2]1[CH2:3][CH:4]([CH3:13])[CH:5]([C:8](=[O:9])[O:10][CH2:11][CH3:12])[CH2:6][CH2:7]1)[C:17]([c:16]1[c:15]([Cl:14])[cH:23][cH:22][c:21]([C:24]([F:25])([F:26])[F:27])[cH:20]1)=[O:18]

참가 물질

반응물 3

HCID 8028Tetrahydrofuran

HCID 27781062-Chloro-5-(trifluoromethyl)benzoyl chloride

HCID 57465891Ethyl 4-amino-2-methylcyclohexane-1-carboxylate

생성물 1

HCID 57465893Ethyl 4-(2-chloro-5-(trifluoromethyl)benzamido)-2-methylcyclohexane carboxylate

출처 및 근거

ORD 기록: ord-eec16893939c4589abf257ecd52cde2b
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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