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Water → 6-nitro-2,2-dimethyl-3-(methoxycarbonylamino)methyl-4-(2-oxo-1,2-dihydropyridin-1-yl)-2H-1-benzopyran

HRID 306439
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HRID 306439 반응식
[CH3:25][CH2:26][N:27]([CH2:28][CH3:29])[CH2:30][CH3:31].[Cl:32][C:33](=[O:34])[O:35][CH3:36].[Cl:38][CH2:39][Cl:40].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]2[c:8]([cH:24]1)[C:9]([n:17]1[c:18](=[O:23])[cH:19][cH:20][cH:21][cH:22]1)=[C:10]([CH2:15][NH2:16])[C:11]([CH3:13])([CH3:14])[O:12]2.[OH2:37]>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]2[c:8]([cH:24]1)[C:9]([n:17]1[c:18](=[O:23])[cH:19][cH:20][cH:21][cH:22]1)=[C:10]([CH2:15][NH:16][C:33](=[O:34])[O:35][CH3:36])[C:11]([CH3:13])([CH3:14])[O:12]2
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반응물 5

HCID 962WaterHCID 6344DichloromethaneHCID 6586Methyl chloroformateHCID 8471TriethylamineHCID 193870526-nitro-2,2-dimethyl-3-aminomethyl-4-(2-oxo-1,2-dihydropyridin-1-yl)-2H-1-benzopyran

생성물 1

HCID 193871646-nitro-2,2-dimethyl-3-(methoxycarbonylamino)methyl-4-(2-oxo-1,2-dihydropyridin-1-yl)-2H-1-benzopyran
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출처 및 근거

ORD 기록
ord-485e9bef44da4a27b0414b8eec67c818
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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