Tetrahydrofuran → 4-Cyano-4'-[[(3-ethoxycarbonylpiperidino)carbonyl]methyloxy]biphenyl

HRID 2123039

반응식

HRID 2123039 반응식
[C:13](=[O:14])([OH:15])[CH2:16][O:17][c:18]1[cH:19][cH:20][c:21](-[c:24]2[cH:25][cH:26][c:27]([C:30]#[N:31])[cH:28][cH:29]2)[cH:22][cH:23]1.[C:1]([c:2]1[nH:3][cH:4][cH:5][n:6]1)([c:7]1[nH:8][cH:9][cH:10][n:11]1)=[O:12].[NH:32]1[CH2:33][CH:34]([C:38](=[O:39])[O:40][CH2:41][CH3:42])[CH2:35][CH2:36][CH2:37]1.[O:43]1[CH2:44][CH2:45][CH2:46][CH2:47]1>>[C:13](=[O:15])([CH2:16][O:17][c:18]1[cH:19][cH:20][c:21](-[c:24]2[cH:25][cH:26][c:27]([C:30]#[N:31])[cH:28][cH:29]2)[cH:22][cH:23]1)[N:32]1[CH2:33][CH:34]([C:38](=[O:39])[O:40][CH2:41][CH3:42])[CH2:35][CH2:36][CH2:37]1

참가 물질

5

반응물 4

HCID 8028TetrahydrofuranHCID 98969Ethyl nipecotateHCID 5250894Bis-(1H-imidazol-2-YL)-methanoneHCID 432431004-(Carboxymethyloxy)-4'-cyano-biphenyl

생성물 1

HCID 538027554-Cyano-4'-[[(3-ethoxycarbonylpiperidino)carbonyl]methyloxy]biphenyl

출처 및 근거

ORD 기록
ord-7f5afb8e0d9b479a962d60e09e3a3425
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

연결된 노트

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