Ammonia → 7-(3,4-Dichlorophenyl)-1,12-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-5(16),6,8-triene

반응식

[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH:10]2[CH:11]([N:12]3[CH2:13][CH2:14][CH2:15][c:16]4[cH:17][c:18](-[c:22]5[cH:23][c:24]([Cl:29])[c:25]([Cl:28])[cH:26][cH:27]5)[cH:19][c:20]2[c:21]43)[CH2:30][CH2:31]1)([CH3:5])([CH3:6])[CH3:7].[NH3:32]>>[NH:8]1[CH2:9][CH:10]2[CH:11]([N:12]3[CH2:13][CH2:14][CH2:15][c:16]4[cH:17][c:18](-[c:22]5[cH:23][c:24]([Cl:29])[c:25]([Cl:28])[cH:26][cH:27]5)[cH:19][c:20]2[c:21]43)[CH2:30][CH2:31]1

참가 물질

반응물 2

HCID 222Ammonia

HCID 10027218Tert-butyl 7-(3,4-dichlorophenyl)-1,12-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-5(16),6,8-triene-12-carboxylate

생성물 1

HCID 104061417-(3,4-Dichlorophenyl)-1,12-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-5(16),6,8-triene

출처 및 근거

ORD 기록: ord-f2e56c553afb4ec3bc2e8731a83e03b3
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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