4-[(4-Chlorophenyl)ethynyl]benzaldehyde → 6-({4-[(4-chlorophenyl)ethynyl]benzyl}amino)-2,2-dimethyl-4H-1,3-benzodioxin-4-one

HRID 96108

반응식

HRID 96108 반응식
[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]#[C:9][c:10]2[cH:11][cH:12][c:13]([CH:14]=[O:15])[cH:16][cH:17]2)[cH:6][cH:7]1.[NH2:18][c:19]1[cH:20][c:21]2[c:22]([cH:30][cH:31]1)[O:23][C:24]([CH3:28])([CH3:29])[O:25][C:26]2=[O:27]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]#[C:9][c:10]2[cH:11][cH:12][c:13]([CH2:14][NH:18][c:19]3[cH:20][c:21]4[c:22]([cH:30][cH:31]3)[O:23][C:24]([CH3:28])([CH3:29])[O:25][C:26]4=[O:27])[cH:16][cH:17]2)[cH:6][cH:7]1

참가 물질

3

반응물 2

HCID 112534834-[(4-Chlorophenyl)ethynyl]benzaldehydeHCID 116153306-Amino-2,2-dimethyl-benzo[1,3]dioxin-4-one

생성물 1

HCID 111543016-({4-[(4-chlorophenyl)ethynyl]benzyl}amino)-2,2-dimethyl-4H-1,3-benzodioxin-4-one

출처 및 근거

ORD 기록
ord-a50c97889e2341019c7d2b7404bdd765
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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