Acetic Acid → 3-(1,3-Dioxobenzo[e]isoindolin-2-yl)-3-(3-ethoxy-4-methoxyphenyl)propanenitrile

HRID 1535814

반응식

HRID 1535814 반응식
[C:1]1(=[O:15])[O:2][C:3](=[O:14])[c:4]2[c:5]1[c:6]1[cH:7][cH:8][cH:9][cH:10][c:11]1[cH:12][cH:13]2.[CH3:32][C:33](=[O:34])[OH:35].[NH2:16][CH:17]([CH2:18][C:19]#[N:20])[c:21]1[cH:22][c:23]([O:29][CH2:30][CH3:31])[c:24]([O:27][CH3:28])[cH:25][cH:26]1>>[C:1]1(=[O:15])[c:5]2[c:4]([cH:13][cH:12][c:11]3[c:6]2[cH:7][cH:8][cH:9][cH:10]3)[C:3](=[O:14])[N:16]1[CH:17]([CH2:18][C:19]#[N:20])[c:21]1[cH:22][c:23]([O:29][CH2:30][CH3:31])[c:24]([O:27][CH3:28])[cH:25][cH:26]1

참가 물질

4

반응물 3

HCID 176Acetic AcidHCID 214371,2-Naphthalenedicarboxylic anhydrideHCID 221771543-Amino-3-(3-ethoxy-4-methoxyphenyl)propanenitrile

생성물 1

HCID 115168893-(1,3-Dioxobenzo[e]isoindolin-2-yl)-3-(3-ethoxy-4-methoxyphenyl)propanenitrile

출처 및 근거

ORD 기록
ord-1fe2b14b9e634463b5f12a8fd35ad147
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

연결된 노트

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