Ethanol → 6-(((dimethylamino)ethyl)amino)-3-hydroxy-4-nitro-7H-indeno[2,1-c]quinoline-7-on

HRID 1214274Notes

Reaction equation

HRID 1214274 reaction equation
[CH2:35]([O:36][CH2:37][CH3:38])[CH3:39].[CH2:40]([OH:41])[CH3:42].[CH3:1][N:2]([CH3:3])[CH2:4][CH2:5][NH:6][c:7]1[n:8][c:9]2[cH:10][c:11]([OH:25])[cH:12][cH:13][c:14]2[c:15]2[c:16]1[C:17](=[O:24])[c:18]1[cH:19][cH:20][cH:21][cH:22][c:23]1-2.[CH3:44][OH:45].[CH:46]([Cl:47])([Cl:48])[Cl:49].[OH2:43].[OH:31][N+:32]([O-:33])=[O:34].[S:26](=[O:27])(=[O:28])([OH:29])[OH:30]>>[CH3:1][N:2]([CH3:3])[CH2:4][CH2:5][NH:6][c:7]1[n:8][c:9]2[c:10]([N+:32](=[O:31])[O-:33])[c:11]([OH:25])[cH:12][cH:13][c:14]2[c:15]2[c:16]1[C:17](=[O:24])[c:18]1[cH:19][cH:20][cH:21][cH:22][c:23]1-2

Participants

9

Reactant 8

HCID 702EthanolHCID 887MethanolHCID 944Nitric AcidHCID 962WaterHCID 1118Sulfuric AcidHCID 3283Diethyl EtherHCID 6212ChloroformHCID 135413533TAS-103 free base

Product 1

HCID 1359669146-(((dimethylamino)ethyl)amino)-3-hydroxy-4-nitro-7H-indeno[2,1-c]quinoline-7-on

Sources & evidence

ORD record
ord-d9a79d29a7e44738a0ea3474eea827a6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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