Dichloromethane → vinyl 5-(3-bromo-4-fluorophenyl)-4,6-dioxo-4,5,6,7,9,10-hexahydro-1H-pyrano[3,4-b][1,7]naphthyridine-8(3H)-carboxylate

HRID 179435

반응식

HRID 179435 반응식
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][C:10](=[O:31])[C:11]2=[C:16]([NH:15][C:14]3=[C:13]([CH:12]2[c:23]2[cH:24][c:25]([Br:30])[c:26]([F:29])[cH:27][cH:28]2)[C:21](=[O:22])[CH2:20][O:19][CH2:18]3)[CH2:17]1.[CH2:38]([Cl:39])[Cl:40].[Cl:32][C:33](=[O:34])[O:35][CH:36]=[CH2:37]>>[N:8]1([C:33](=[O:34])[O:35][CH:36]=[CH2:37])[CH2:9][C:10](=[O:31])[C:11]2=[C:16]([NH:15][C:14]3=[C:13]([CH:12]2[c:23]2[cH:24][c:25]([Br:30])[c:26]([F:29])[cH:27][cH:28]2)[C:21](=[O:22])[CH2:20][O:19][CH2:18]3)[CH2:17]1

참가 물질

4

반응물 3

HCID 6344DichloromethaneHCID 78808Vinyl chloroformateHCID 121240088-benzyl-5-(3-bromo-4-fluorophenyl)-5,8,9,10-tetrahydro-1H-pyrano[3,4-b][1,7]naphthyridine-4,6(3H,7H)-dione

생성물 1

HCID 18000982vinyl 5-(3-bromo-4-fluorophenyl)-4,6-dioxo-4,5,6,7,9,10-hexahydro-1H-pyrano[3,4-b][1,7]naphthyridine-8(3H)-carboxylate

출처 및 근거

ORD 기록
ord-d72798f4eea3406abe52c92eb7be0148
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

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