Benzaldehyde → 1-benzyl-3-benzylaminomethyl-3,4,5,6-tetrahydro-6-oxo-1H-azepino[5,4,3-cd]indole

반응식

[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[n:9]1[cH:10][c:11]2[c:12]3[c:13]([cH:14][cH:15][cH:16][c:17]13)[C:18](=[O:24])[NH:19][CH2:20][CH:21]2[CH2:22][NH2:23].[CH:25](=[O:26])[c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[ClH:1]>>[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[n:9]1[cH:10][c:11]2[c:12]3[c:13]([cH:14][cH:15][cH:16][c:17]13)[C:18](=[O:24])[NH:19][CH2:20][CH:21]2[CH2:22][NH:23][CH2:25][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1

참가 물질

반응물 3

HCID 240Benzaldehyde

HCID 313Hydrochloric Acid

HCID 19734251HCID 19734251, 화합물

생성물 1

HCID 197342621-benzyl-3-benzylaminomethyl-3,4,5,6-tetrahydro-6-oxo-1H-azepino[5,4,3-cd]indole

출처 및 근거

ORD 기록: ord-ce8e43157b5e45a899236353b786dabb
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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