1-Cyclooctene → 2-Trifluoromethoxy-5,6,6a,7,8,9,10,11,12,12a-decahydro-5-aza-cycloocta-[a]naphthalene-6-carboxylic acid ethyl ester

HRID 682678

반응식

HRID 682678 반응식
[CH2:13]([CH3:14])[O:15][C:16]([CH:17]=[O:18])=[O:19].[CH:20]1=[CH:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27]1.[F:1][C:2]([O:3][c:4]1[cH:5][cH:6][c:7]([NH2:8])[cH:9][cH:10]1)([F:11])[F:12]>>[F:1][C:2]([O:3][c:4]1[cH:5][c:6]2[c:7]([cH:9][cH:10]1)[NH:8][CH:17]([C:16]([O:15][CH2:13][CH3:14])=[O:19])[CH:20]1[CH:21]2[CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27]1)([F:11])[F:12]

참가 물질

4

반응물 3

HCID 136091-CycloocteneHCID 70211Ethyl oxoacetateHCID 6008484-(Trifluoromethoxy)aniline

생성물 1

HCID 101337972-Trifluoromethoxy-5,6,6a,7,8,9,10,11,12,12a-decahydro-5-aza-cycloocta-[a]naphthalene-6-carboxylic acid ethyl ester

출처 및 근거

ORD 기록
ord-e551ac45d830418dbb5dadd6e520fbd1
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

연결된 노트

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