3-(2-Nitrophenyl)acrylic acid → HCID 178449055, 화합물

HRID 296512

반응식

HRID 296512 반응식
[CH2:1]([CH:2]([CH3:3])[CH3:4])[N:5]([CH:6]([CH2:7][CH2:8][CH2:9][CH2:10][NH2:11])[C:12](=[O:13])[OH:14])[S:15](=[O:16])(=[O:17])[c:18]1[cH:19][cH:20][c:21]([N+:24](=[O:25])[O-:26])[cH:22][cH:23]1.[N+:27](=[O:28])([O-:29])[c:30]1[c:31]([CH:32]=[CH:33][C:34](=[O:35])[OH:36])[cH:37][cH:38][cH:39][cH:40]1>>[CH2:1]([CH:2]([CH3:3])[CH3:4])[N:5]([CH:6]([CH2:7][CH2:8][CH2:9][CH2:10][NH:11][C:34]([CH:33]=[CH:32][c:31]1[c:30]([N+:27](=[O:28])[O-:29])[cH:40][cH:39][cH:38][cH:37]1)=[O:35])[C:12](=[O:13])[OH:14])[S:15](=[O:16])(=[O:17])[c:18]1[cH:19][cH:20][c:21]([N+:24](=[O:25])[O-:26])[cH:22][cH:23]1

참가 물질

3

출처 및 근거

ORD 기록
ord-47b7d0f9acb748c895fc73ee4f9d8604
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

연결된 노트

불러오는 중…