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Hydrochloric Acid → 3-(2,2-Difluoro-benzo[1,3]dioxol-5-ylmethyl)-piperidine-1-carboxylic acid pyridin-3-ylamide

HRID 1123037
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반응식

HRID 1123037 반응식
[CH3:20][CH2:21][N:22]([CH2:23][CH3:24])[CH2:25][CH3:26].[CH3:43][C:44]#[N:45].[ClH:1].[F:2][C:3]1([F:19])[O:4][c:5]2[c:6]([cH:8][cH:9][c:10]([CH2:12][CH:13]3[CH2:14][NH:15][CH2:16][CH2:17][CH2:18]3)[cH:11]2)[O:7]1.[c:27]1([O:33][C:34](=[O:28])[NH:35][c:36]2[cH:37][n:38][cH:39][cH:40][cH:41]2)[cH:29][cH:30][cH:31][cH:32][cH:42]1>>[F:2][C:3]1([F:19])[O:4][c:5]2[c:6]([cH:8][cH:9][c:10]([CH2:12][CH:13]3[CH2:14][N:15]([C:34](=[O:33])[NH:35][c:36]4[cH:37][n:38][cH:39][cH:40][cH:41]4)[CH2:16][CH2:17][CH2:18]3)[cH:11]2)[O:7]1
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반응물 5

HCID 313Hydrochloric AcidHCID 6342AcetonitrileHCID 8471TriethylamineHCID 6935890Phenyl pyridin-3-ylcarbamateHCID 673906353-[(2,2-Difluoro-1,3-benzodioxol-5-yl)methyl]-piperidine

생성물 1

HCID 462354193-(2,2-Difluoro-benzo[1,3]dioxol-5-ylmethyl)-piperidine-1-carboxylic acid pyridin-3-ylamide

출처 및 근거

ORD 기록
ord-9a3a3731903b4f2a9df3dd4ee255fe72
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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