Ethyl oxoacetate → 6-Sec-butyl-4-(6-chlorobenzo[1,3]dioxol-5-yl)-1,2,3,4-tetrahydroquinoline-2-carboxylic acid ethyl ester

HRID 1545340

반응식

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

참가 물질

반응물 3

HCID 70211Ethyl oxoacetate

HCID 121771Benzenamine, 4-(1-methylpropyl)-

HCID 121749915-Chloro-6-vinyl-benzo[1,3]dioxol

생성물 1

HCID 101125646-Sec-butyl-4-(6-chlorobenzo[1,3]dioxol-5-yl)-1,2,3,4-tetrahydroquinoline-2-carboxylic acid ethyl ester

출처 및 근거

ORD 기록: ord-040a1b13641c4992adc477b886104f6d
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

연결된 노트

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