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Sodium Ion → tert-butyl 4-[4-[3-methoxy-5-(trifluoromethyl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperazin-1-yl]-4-methylpiperidine-1-carboxylate

HRID 669115
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인쇄 미리보기

반응식

HRID 669115 반응식
[CH3:38][I:39].[H-:1].[Na+:2].[O:40]1[CH2:41][CH2:42][CH2:43][CH2:44]1.[OH:3][CH:4]1[CH2:5][CH:6]([N:17]2[CH:18]([CH3:37])[CH2:19][N:20]([C:23]3([CH3:36])[CH2:24][CH2:25][N:26]([C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[CH2:27][CH2:28]3)[CH2:21][CH2:22]2)[c:7]2[cH:8][cH:9][c:10]([C:13]([F:14])([F:15])[F:16])[cH:11][c:12]21>>[O:3]([CH:4]1[CH2:5][CH:6]([N:17]2[CH:18]([CH3:37])[CH2:19][N:20]([C:23]3([CH3:36])[CH2:24][CH2:25][N:26]([C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[CH2:27][CH2:28]3)[CH2:21][CH2:22]2)[c:7]2[cH:8][cH:9][c:10]([C:13]([F:14])([F:15])[F:16])[cH:11][c:12]21)[CH3:38]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 923Sodium IonHCID 6328Methyl iodideHCID 8028TetrahydrofuranHCID 166653HydrideHCID 68741680tert-butyl 4-{4-[3-hydroxy-5-(trifluoromethyl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperazin-1-yl}-4-methylpiperidine-1-carboxylate

생성물 1

HCID 72531954
tert-butyl 4-[4-[3-methoxy-5-(trifluoromethyl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperazin-1-yl]-4-methylpiperidine-1-carboxylate

출처 및 근거

ORD 기록
ord-fff29b8522a44cb1a5f9695b78188c49
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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