Ethanol → 1,1-Dimethylethyl 6-cyano-1-[4-(ethyloxy)-4-oxobutyl]-5-methyl-3,4-dihydro-2(1H)-isoquinolinecarboxylate

반응식

[C:1](#[N:2])[c:3]1[c:4]([CH3:28])[c:5]2[c:10]([cH:11][cH:12]1)[CH:9]([CH2:13][CH:14]=[CH:15][C:16](=[O:17])[O:18][CH2:19][CH3:20])[N:8]([C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[CH2:7][CH2:6]2.[CH3:31][CH2:32][OH:33].[H:29][H:30]>>[C:1](#[N:2])[c:3]1[c:4]([CH3:28])[c:5]2[c:10]([cH:11][cH:12]1)[CH:9]([CH2:13][CH2:14][CH2:15][C:16](=[O:17])[O:18][CH2:19][CH3:20])[N:8]([C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[CH2:7][CH2:6]2

참가 물질

반응물 3

HCID 702Ethanol

HCID 68733897tert-butyl 6-cyano-1-(4-ethoxy-4-oxobut-2-enyl)-5-methyl-3,4-dihydro-1H-isoquinoline-2-carboxylate

HCID 178418361HCID 178418361, 화합물

생성물 1

HCID 595910941,1-Dimethylethyl 6-cyano-1-[4-(ethyloxy)-4-oxobutyl]-5-methyl-3,4-dihydro-2(1H)-isoquinolinecarboxylate

출처 및 근거

ORD 기록: ord-886c47965fd84b7f94d0768252ef3f03
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

반응 노트

불러오는 중…