6-[diethyl-(4-nitrophenyl)azaniumyl]hexyl-diethyl-(4-nitrophenyl)azanium dibromide

Systemtic Name: 6-[diethyl-(4-nitrophenyl)azaniumyl]hexyl-diethyl-(4-nitrophenyl)azanium dibromide Openeye Name: 6-[diethyl-(4-nitrophenyl)ammonio]hexyl-diethyl-(4-nitrophenyl)ammonium dibromide CAS Name: 6-[diethyl-(4-nitrophenyl)ammonio]hexyl-diethyl-(4-nitrophenyl)ammonium dibromide IUPAC Name: 6-[diethyl-(4-nitrophenyl)azaniumyl]hexyl-diethyl-(4-nitrophenyl)azanium dibromide Traditional Name: 6-[diethyl-(4-nitrophenyl)ammonio]hexyl-diethyl-(4-nitrophenyl)ammonium dibromide Formula: C26H40Br2N4O4 MolecularWeight: 632.4282

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CCCCCC[N+](CC)(CC)C1=CC=C(C=C1)[N+](=O)[O-])C2=CC=C(C=C2)[N+](=O)[O-].[Br-].[Br-]

Isomeric SMILES

CC[N+](CC)(CCCCCC[N+](CC)(CC)C1=CC=C(C=C1)[N+](=O)[O-])C2=CC=C(C=C2)[N+](=O)[O-].[Br-].[Br-]

InChI

InChI=1S/C26H40N4O4.2BrH/c1-5-29(6-2,25-17-13-23(14-18-25)27(31)32)21-11-9-10-12-22-30(7-3,8-4)26-19-15-24(16-20-26)28(33)34;;/h13-20H,5-12,21-22H2,1-4H3;2*1H/q+2;;/p-2