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Acetone → 2-methoxy-N-methyl-N-(2-phenylpent-4-enyl)-5-(tetrazol-1-yl)benzamide

HRID 2162369
노트
인쇄 미리보기

반응식

HRID 2162369 반응식
[C:14](=[O:15])([OH:16])[O-:17].[CH3:19][O:20][c:21]1[c:22]([C:23](=[O:24])[Cl:25])[cH:26][c:27](-[n:30]2[n:31][n:32][n:33][cH:34]2)[cH:28][cH:29]1.[CH3:1][NH:2][CH2:3][CH:4]([CH2:5][CH:6]=[CH2:7])[c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1.[CH3:36][C:37]([CH3:38])=[O:39].[Na+:18].[OH2:35]>>[CH3:1][N:2]([CH2:3][CH:4]([CH2:5][CH:6]=[CH2:7])[c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[C:23]([c:22]1[c:21]([O:20][CH3:19])[cH:29][cH:28][c:27](-[n:30]2[n:31][n:32][n:33][cH:34]2)[cH:26]1)=[O:24]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 180AcetoneHCID 769Bicarbonate IonHCID 923Sodium IonHCID 962WaterHCID 153920222-Methoxy-5-(1H-tetrazol-1-yl)benzoyl ChlorideHCID 18354441N-methyl-(2-phenylpent-4-enyl)amine

생성물 1

HCID 183545022-methoxy-N-methyl-N-(2-phenylpent-4-enyl)-5-(tetrazol-1-yl)benzamide

출처 및 근거

ORD 기록
ord-5a917756f3724413bc7116ca70a1b039
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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