Toluene → N,N-dimethyl-N-(4-butyl-2',3',4',9'-tetrahydro-1H-spiro[cyclohexane-1,1'-carbazole]-4-yl)amine

HRID 696834Notes

Reaction equation

HRID 696834 reaction equation
[Cl:45][CH2:46][Cl:47].[c:1]1([CH3:2])[c:3]([S:4]([OH:5])(=[O:6])=[O:7])[cH:8][c:9]([OH:10])[cH:11][cH:12]1.[c:38]1([CH3:39])[cH:40][cH:41][cH:42][cH:43][cH:44]1.[nH:13]1[cH:14][c:15]([CH2:22][CH2:23][CH:24]=[C:25]2[CH2:26][CH2:27][C:28]([N:31]([CH3:32])[CH3:33])([CH2:34][CH2:35][CH2:36][CH3:37])[CH2:29][CH2:30]2)[c:16]2[cH:17][cH:18][cH:19][cH:20][c:21]12>>[nH:13]1[c:14]2[c:15]([c:16]3[cH:17][cH:18][cH:19][cH:20][c:21]13)[CH2:22][CH2:23][CH2:24][C:25]21[CH2:26][CH2:27][C:28]([N:31]([CH3:32])[CH3:33])([CH2:34][CH2:35][CH2:36][CH3:37])[CH2:29][CH2:30]1

Participants

5

Reactant 4

HCID 1140TolueneHCID 6344DichloromethaneHCID 190387205-Hydroxy-2-methylbenzenesulfonic acidHCID 686406974-[3-(1H-indol-3-yl)propylidene]-1-butyl-N,N-dimethylcyclohexanamine

Product 1

HCID 44224243N,N-dimethyl-N-(4-butyl-2',3',4',9'-tetrahydro-1H-spiro[cyclohexane-1,1'-carbazole]-4-yl)amine

Sources & evidence

ORD record
ord-6d27df0d0f18401991cdfed391cc306d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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