Hydrochloric Acid → Ethyl 2-(5-benzoyl-1,4-dimethylpyrrol-2-yl)-2-(2-fluoro-4-aminophenyl)acetate

반응식

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

참가 물질

반응물 3

HCID 313Hydrochloric Acid

HCID 887Methanol

HCID 15870183Ethyl 2-(5-benzoyl-1,4-dimethylpyrrol-2-yl)-2-(2-fluoro-4-nitrophenyl)acetate

생성물 1

HCID 15870184Ethyl 2-(5-benzoyl-1,4-dimethylpyrrol-2-yl)-2-(2-fluoro-4-aminophenyl)acetate

출처 및 근거

ORD 기록: ord-57ddfe37527649bc8b5455754f06ca49
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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