Formic Acid → 4-[N-(5-Bromo-2-benzyloxybenzyl)-N-(4-methoxycarbonylbenzyl)amino]benzoic acid

반응식

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

참가 물질

반응물 2

HCID 284Formic Acid

HCID 22675539tert-Butyl 4-[N-(5-bromo-2-benzyloxybenzyl)-N-(4-methoxycarbonylbenzyl)amino]benzoate

생성물 1

HCID 226755684-[N-(5-Bromo-2-benzyloxybenzyl)-N-(4-methoxycarbonylbenzyl)amino]benzoic acid

출처 및 근거

ORD 기록: ord-f8ce8c847de84ba5ba8acaa9157ae8b2
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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