1-Fluoro-3-iodo-5-nitrobenzene → 4,4-diethyl-6-(3-fluoro-5-nitrophenylamino)-1-methyl-1H-benzo[d][1,3]oxazin-2(4H)-one

반응식

[F:18][c:19]1[cH:20][c:21]([I:28])[cH:22][c:23]([N+:25](=[O:26])[O-:27])[cH:24]1.[NH2:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:17]1)[C:7]([CH2:13][CH3:14])([CH2:15][CH3:16])[O:8][C:9](=[O:12])[N:10]2[CH3:11]>>[NH:1]([c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:17]1)[C:7]([CH2:13][CH3:14])([CH2:15][CH3:16])[O:8][C:9](=[O:12])[N:10]2[CH3:11])[c:21]1[cH:20][c:19]([F:18])[cH:24][c:23]([N+:25](=[O:26])[O-:27])[cH:22]1

참가 물질

반응물 2

HCID 2590861-Fluoro-3-iodo-5-nitrobenzene

HCID 692163266-amino-4,4-diethyl-1-methyl-1,4-dihydro-2H-3,1-benzoxazin-2-one

생성물 1

HCID 111879384,4-diethyl-6-(3-fluoro-5-nitrophenylamino)-1-methyl-1H-benzo[d][1,3]oxazin-2(4H)-one

출처 및 근거

ORD 기록: ord-5db1c1a5575c4070a18f0890fabe1cd1
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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