Toluene → HCID 178493621, 화합물

HRID 193512

반응식

HRID 193512 반응식
[C:19]([CH3:20])([CH3:21])([CH3:22])[c:23]1[o:24][c:25]2[c:26]([c:27]1[CH:28]=[O:29])[c:30]([SiH:36]([CH3:37])[CH3:38])[cH:31][c:32]([O:34][CH3:35])[cH:33]2.[CH2:14]([Li:15])[CH2:16][CH2:17][CH3:18].[CH3:1][O:2][c:3]1[cH:4][c:5]([I:13])[cH:6][c:7]([O:11][CH3:12])[c:8]1[O:9][CH3:10].[CH3:58][c:59]1[cH:60][cH:61][cH:62][cH:63][cH:64]1.[Cl:39][C:40]1=[C:51]([Cl:52])[C:49](=[O:50])[C:46]([C:47]#[N:48])=[C:43]([C:44]#[N:45])[C:41]1=[O:42].[O:53]1[CH2:54][CH2:55][CH2:56][CH2:57]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]([C:28]([c:27]2[c:23]([C:19]([CH3:20])([CH3:21])[CH3:22])[o:24][c:25]3[c:26]2[c:30]([SiH:36]([CH3:37])[CH3:38])[cH:31][c:32]([O:34][CH3:35])[cH:33]3)=[O:29])[cH:6][c:7]([O:11][CH3:12])[c:8]1[O:9][CH3:10]

참가 물질

7

출처 및 근거

ORD 기록
ord-f387d268618644f5ae8060060dbb72d9
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

불러오는 중…