Sodium ion → 8-(2,4-Dimethylphenyl)-2-methyl-4-(1-propylbutyl)-2H-1,4-benzoxazin-3(4H)-one

HRID 2316887노트

반응식

HRID 2316887 반응식
[Br:23][CH:24]([CH2:25][CH2:26][CH3:27])[CH2:28][CH2:29][CH3:30].[CH3:1][c:2]1[c:3](-[c:9]2[cH:10][cH:11][cH:12][c:13]3[c:18]2[O:17][CH:16]([CH3:19])[C:15](=[O:20])[NH:14]3)[cH:4][cH:5][c:6]([CH3:8])[cH:7]1.[CH3:31][N:32]([CH3:33])[CH:34]=[O:35].[H-:21].[Na+:22].[OH2:36]>>[CH3:1][c:2]1[c:3](-[c:9]2[cH:10][cH:11][cH:12][c:13]3[c:18]2[O:17][CH:16]([CH3:19])[C:15](=[O:20])[N:14]3[CH:24]([CH2:25][CH2:26][CH3:27])[CH2:28][CH2:29][CH3:30])[cH:4][cH:5][c:6]([CH3:8])[cH:7]1

참가 물질

7

출처 및 근거

ORD 기록
ord-60d6e3212d6644dbae78d9c90b865270
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

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