Methanesulfonyl chloride → 3-(3,4-Dichlorophenyl)-1-(3,4,5-trimethoxybenzoyl)-3-pyrrolidineethanol methansulfonate

반응식

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

참가 물질

반응물 2

HCID 31297Methanesulfonyl chloride

HCID 184644171-(3,4,5-Trimethoxybenzoyl)-3-(3,4-dichlorophenyl)-3-(2-hydroxyethyl)pyrrolidine

생성물 1

HCID 158408993-(3,4-Dichlorophenyl)-1-(3,4,5-trimethoxybenzoyl)-3-pyrrolidineethanol methansulfonate

출처 및 근거

ORD 기록: ord-8df78a2fa0c64cceb4aa36fa91fdff52
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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