Methyl Ethyl Ketone → o-Anisamide, 5-chloro-N-((1-ethyl-2-pyrrolidinyl)methyl)-4-methyl-

반응식

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

참가 물질

반응물 3

HCID 6569Methyl Ethyl Ketone

HCID 1172952-Aminomethyl-1-ethylpyrrolidine

HCID 215361405-Chloro-2-methoxy-4-methylbenzoyl chloride

생성물 1

HCID 206709o-Anisamide, 5-chloro-N-((1-ethyl-2-pyrrolidinyl)methyl)-4-methyl-

출처 및 근거

ORD 기록: ord-e58bec58acd949c49d4f9ae213613cee
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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