6-bromanyl-8-[[4-(dimethylamino)piperidin-1-yl]methyl]-5-nitro-1,4-dihydroquinoxaline-2,3-dione dihydrobromide

Systemtic Name: 6-bromanyl-8-[[4-(dimethylamino)piperidin-1-yl]methyl]-5-nitro-1,4-dihydroquinoxaline-2,3-dione dihydrobromide Openeye Name: 6-bromo-8-[[4-(dimethylamino)-1-piperidyl]methyl]-5-nitro-1,4-dihydroquinoxaline-2,3-dione dihydrobromide CAS Name: 6-bromo-8-[[4-(dimethylamino)-1-piperidinyl]methyl]-5-nitro-1,4-dihydroquinoxaline-2,3-dione dihydrobromide IUPAC Name: 6-bromo-8-[[4-(dimethylamino)piperidin-1-yl]methyl]-5-nitro-1,4-dihydroquinoxaline-2,3-dione dihydrobromide Traditional Name: 6-bromo-8-[[4-(dimethylamino)piperidino]methyl]-5-nitro-1,4-dihydroquinoxaline-2,3-quinone dihydrobromide Formula: C16H22Br3N5O4 MolecularWeight: 588.08898

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCN(CC1)CC2=CC(=C(C3=C2NC(=O)C(=O)N3)[N+](=O)[O-])Br.Br.Br

Isomeric SMILES

CN(C)C1CCN(CC1)CC2=CC(=C(C3=C2NC(=O)C(=O)N3)[N+](=O)[O-])Br.Br.Br

InChI

InChI=1S/C16H20BrN5O4.2BrH/c1-20(2)10-3-5-21(6-4-10)8-9-7-11(17)14(22(25)26)13-12(9)18-15(23)16(24)19-13;;/h7,10H,3-6,8H2,1-2H3,(H,18,23)(H,19,24);2*1H