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N-Phenylanthranilic Acid → 1-Acetyl-6-(2-phenylaminobenzoyl)amino-4-phenyl-1,2,3,4-tetrahydro-2,2,4-trimethylquinoline

HRID 171211
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인쇄 미리보기

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HRID 171211 반응식
[C:25]([CH3:26])(=[O:27])[N:28]1[C:29]([CH3:46])([CH3:47])[CH2:30][C:31]([CH3:39])([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[c:32]2[cH:33][c:34]([NH2:38])[cH:35][cH:36][c:37]21.[CH:64]([N:65]([CH2:66][CH3:67])[CH:68]([CH3:69])[CH3:70])([CH3:71])[CH3:72].[O:73]1[CH2:74][CH2:75][CH2:76][CH2:77]1.[P-:1]([F:2])([F:3])([F:4])([F:5])([F:6])[F:7].[c:48]1([NH:54][c:55]2[c:56]([C:57](=[O:58])[OH:59])[cH:60][cH:61][cH:62][cH:63]2)[cH:49][cH:50][cH:51][cH:52][cH:53]1.[n:8]1([O:9][C:10]([N:11]([CH3:12])[CH3:13])=[N+:14]([CH3:15])[CH3:16])[c:17]2[n:18][cH:19][cH:20][cH:21][c:22]2[n:23][n:24]1>>[C:25]([CH3:26])(=[O:27])[N:28]1[C:29]([CH3:46])([CH3:47])[CH2:30][C:31]([CH3:39])([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[c:32]2[cH:33][c:34]([NH:38][C:57]([c:56]3[c:55]([NH:54][c:48]4[cH:49][cH:50][cH:51][cH:52][cH:53]4)[cH:63][cH:62][cH:61][cH:60]3)=[O:58])[cH:35][cH:36][c:37]21
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 4386N-Phenylanthranilic AcidHCID 8028TetrahydrofuranHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 28370841-(6-amino-2,2,4-trimethyl-4-phenyl-3,4-dihydroquinolin-1(2H)-yl)ethanoneHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium

생성물 1

HCID 179629141-Acetyl-6-(2-phenylaminobenzoyl)amino-4-phenyl-1,2,3,4-tetrahydro-2,2,4-trimethylquinoline

출처 및 근거

ORD 기록
ord-c7fc8f2b236e400fae38bd076c6af812
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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