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Hydrochloric Acid → N-Methyl-4-phenyl-4-piperidyl N-(8-trifluoromethyl-4-quinolyl)anthraniloyloxyacetate

HRID 1235341
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HRID 1235341 반응식
[C:45](=[O:46])([O-:47])[O-:48].[CH3:51][N:52]([CH3:53])[CH:54]=[O:55].[Cl:2][CH2:3][C:4](=[O:5])[O:6][C:7]1([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[CH2:8][CH2:9][N:10]([CH3:13])[CH2:11][CH2:12]1.[ClH:1].[F:21][C:22]([c:23]1[cH:24][cH:25][cH:26][c:27]2[c:28]([NH:33][c:34]3[c:35]([C:36](=[O:37])[OH:38])[cH:39][cH:40][cH:41][cH:42]3)[cH:29][cH:30][n:31][c:32]12)([F:43])[F:44].[K+:49].[K+:50].[Na:20]>>[CH2:3]([C:4](=[O:5])[O:6][C:7]1([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[CH2:8][CH2:9][N:10]([CH3:13])[CH2:11][CH2:12]1)[O:38][C:36]([c:35]1[c:34]([NH:33][c:28]2[c:27]3[cH:26][cH:25][cH:24][c:23]([C:22]([F:21])([F:43])[F:44])[c:32]3[n:31][cH:30][cH:29]2)[cH:42][cH:41][cH:40][cH:39]1)=[O:37]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 313Hydrochloric AcidHCID 813Potassium Cation2회HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 37541Floctafenic acidHCID 5360545SodiumHCID 20438866(1-Methyl-4-phenylpiperidin-4-yl) 2-chloroacetate

생성물 1

HCID 16206495N-Methyl-4-phenyl-4-piperidyl N-(8-trifluoromethyl-4-quinolyl)anthraniloyloxyacetate

출처 및 근거

ORD 기록
ord-6699a83a2a6d4b1b9dc019fe0a0a0d49
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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