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Bicarbonate Ion → Tert-butyl 2-benzamido-4-[2-(2-oxo-1,3-dihydroindol-6-yl)ethenyl]benzoate

HRID 291777
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인쇄 미리보기

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HRID 291777 반응식
[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:9]([cH:10]1)[NH:8][C:7](=[O:11])[CH2:6]2.[C:27]([c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)(=[O:34])[NH:35][c:36]1[c:37]([C:38](=[O:39])[O:40][C:41]([CH3:42])([CH3:43])[CH3:44])[cH:45][cH:46][c:47]([CH:49]=[CH2:50])[cH:48]1.[C:51](=[O:52])([O-:53])[OH:54].[CH3:56][CH2:57][O:58][C:59](=[O:60])[CH3:61].[CH3:62][N:63]([CH3:64])[C:65](=[O:66])[CH3:67].[CH:12]1([CH2:13][NH:14][CH2:15][CH:16]2[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21]2)[CH2:22][CH2:23][CH2:24][CH2:25][CH2:26]1.[Na+:55]>>[c:2]1([CH:50]=[CH:49][c:47]2[cH:46][cH:45][c:37]([C:38](=[O:39])[O:40][C:41]([CH3:42])([CH3:43])[CH3:44])[c:36]([NH:35][C:27]([c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)=[O:34])[cH:48]2)[cH:3][cH:4][c:5]2[c:9]([cH:10]1)[NH:8][C:7](=[O:11])[CH2:6]2
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 8857Ethyl AcetateHCID 31374DimethylacetamideHCID 27732896-bromo-2,3-dihydro-1H-indol-2-oneHCID 4594378Bis(cyclohexylmethyl)amineHCID 67343635Tert-butyl 2-(benzamido)-4-vinylbenzoate

생성물

1
HCID 67343578Tert-butyl 2-benzamido-4-[2-(2-oxo-1,3-dihydroindol-6-yl)ethenyl]benzoate

출처 및 근거

ORD 기록
ord-0b125d5a94e649e29ba1e818b706f38b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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