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Bicarbonate Ion → [4-(3-cyano-1-ethyl-6-methoxy-1H-indol-2-yl)-phenyl]-carbamic acid ethyl ester

HRID 1151767
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인쇄 미리보기

반응식

HRID 1151767 반응식
[CH3:29][CH2:30][O:31][C:32]([CH3:33])=[O:34].[Cl:23][C:24](=[O:25])[O:26][CH2:27][CH3:28].[NH2:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9]([CH2:21][CH3:22])[c:10]3[cH:11][c:12]([O:19][CH3:20])[cH:13][cH:14][c:15]3[c:16]2[C:17]#[N:18])[cH:6][cH:7]1.[Na+:39].[O-:35][C:36]([OH:37])=[O:38].[OH2:40]>>[NH:1]([c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9]([CH2:21][CH3:22])[c:10]3[cH:11][c:12]([O:19][CH3:20])[cH:13][cH:14][c:15]3[c:16]2[C:17]#[N:18])[cH:6][cH:7]1)[C:24](=[O:25])[O:26][CH2:27][CH3:28]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 962WaterHCID 8857Ethyl AcetateHCID 10928Ethyl chloroformateHCID 116017362-(4-aminophenyl)-1-ethyl-6-methoxy-1H-indole-3-carbonitrile

생성물 1

HCID 59425255[4-(3-cyano-1-ethyl-6-methoxy-1H-indol-2-yl)-phenyl]-carbamic acid ethyl ester

출처 및 근거

ORD 기록
ord-b88db44de18f4322b4b4c7beaea1176c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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