Phenoxyethanol → 2-phenoxyethyl 5,7-dihydro-6H-dibenz[c,e]azepine-6-carboximidate

HRID 107313

반응식

HRID 107313 반응식
[O:18]([c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)[CH2:25][CH2:26][OH:27].[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:11]1-[c:10]1[c:9]([cH:15][cH:14][cH:13][cH:12]1)[CH2:8][N:7]([C:16]#[N:17])[CH2:6]2>>[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:11]1-[c:10]1[c:9]([cH:15][cH:14][cH:13][cH:12]1)[CH2:8][N:7]([C:16](=[NH:17])[O:27][CH2:26][CH2:25][O:18][c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)[CH2:6]2

참가 물질

3

반응물 2

HCID 31236PhenoxyethanolHCID 198338865,7-dihydro-6H-dibenz[c,e]azepine-6carbonitrile

생성물 1

HCID 198339622-phenoxyethyl 5,7-dihydro-6H-dibenz[c,e]azepine-6-carboximidate

출처 및 근거

ORD 기록
ord-44316562cd7940c189a3113d9bffa11f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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