Tert-butyl 3-amino-2-phenylpiperidine-1-carboxylate → tert-butyl 3-[[5-(4-cyanooxan-4-yl)-2-methoxyphenyl]methylamino]-2-phenylpiperidine-1-carboxylate

HRID 689842

반응식

HRID 689842 반응식
[C:1](#[N:2])[C:3]1([c:9]2[cH:10][cH:11][c:12]([O:17][CH3:18])[c:13]([CH:14]=[O:15])[cH:16]2)[CH2:4][CH2:5][O:6][CH2:7][CH2:8]1.[C:39]([O:40][C:41]([N:42]1[CH2:43][CH2:44][CH2:45][CH:46]([NH:47][CH2:48][c:49]2[cH:50][c:51]([CH:52]([C:53]#[N:54])[CH3:55])[cH:56][cH:57][c:58]2[O:59][CH3:60])[CH:61]1[c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1)=[O:68])([CH3:69])([CH3:70])[CH3:71].[NH2:19][CH:20]1[CH:21]([c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[N:22]([C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])[CH2:23][CH2:24][CH2:25]1>>[C:1](#[N:2])[C:3]1([c:9]2[cH:10][cH:11][c:12]([O:17][CH3:18])[c:13]([CH2:14][NH:19][CH:20]3[CH:21]([c:33]4[cH:34][cH:35][cH:36][cH:37][cH:38]4)[N:22]([C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])[CH2:23][CH2:24][CH2:25]3)[cH:16]2)[CH2:4][CH2:5][O:6][CH2:7][CH2:8]1

참가 물질

4

반응물 3

HCID 10214733Tert-butyl 3-amino-2-phenylpiperidine-1-carboxylateHCID 190665075-(1-Cyano-4-oxa-cyclohexyl)-2-methoxybenzaldehydeHCID 178490144HCID 178490144, 화합물

생성물 1

HCID 178488762tert-butyl 3-[[5-(4-cyanooxan-4-yl)-2-methoxyphenyl]methylamino]-2-phenylpiperidine-1-carboxylate

출처 및 근거

ORD 기록
ord-6d34c07c40d0427eae4735ab3fde6e9f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

연결된 노트

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