8-Furan-3-yl-1,1-dimethyl-1,2,3,6-tetrahydroazepino[4,5-b]indole-5-carboxylic acid ethyl ester → 8-(3-Methoxyphenyl)-1,2,3,6-tetrahydroazepino[4,5-B]indole-5-carboxylic acid ethyl ester

반응식

[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[C:6]1=[CH:7][NH:8][CH2:9][C:10]([CH3:28])([CH3:29])[c:11]2[c:12]1[nH:13][c:14]1[cH:15][c:16](-[c:20]3[cH:21][c:22]([O:26][CH3:27])[cH:23][cH:24][cH:25]3)[cH:17][cH:18][c:19]21.[CH2:30]([O:31][C:32]([C:33]1=[CH:53][NH:52][CH2:51][C:48]([CH3:49])([CH3:50])[c:47]2[c:34]1[nH:35][c:36]1[cH:37][c:38](-[c:39]3[cH:40][cH:41][o:42][cH:43]3)[cH:44][cH:45][c:46]12)=[O:54])[CH3:55]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[C:6]1=[CH:7][NH:8][CH2:9][CH2:10][c:11]2[c:12]1[nH:13][c:14]1[cH:15][c:16](-[c:20]3[cH:21][c:22]([O:26][CH3:27])[cH:23][cH:24][cH:25]3)[cH:17][cH:18][c:19]21

참가 물질

반응물 2

HCID 113715488-Furan-3-yl-1,1-dimethyl-1,2,3,6-tetrahydroazepino[4,5-b]indole-5-carboxylic acid ethyl ester

HCID 66640507Azepino[4,5-b]indole-5-carboxylic acid, 1,2,3,6-tetrahydro-8-(3-methoxyphenyl)-1,1-dimethyl-, ethyl ester

생성물 1

HCID 575591088-(3-Methoxyphenyl)-1,2,3,6-tetrahydroazepino[4,5-B]indole-5-carboxylic acid ethyl ester

출처 및 근거

ORD 기록: ord-69f480223a5847509a5136634b63846b
출처 데이터셋: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D

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