2-methyl-2-[7-[2-methyl-1,3-bis(oxidanylidene)isoindol-2-ium-2-yl]heptyl]isoindol-2-ium-1,3-dione dibromide

Systemtic Name: 2-methyl-2-[7-[2-methyl-1,3-bis(oxidanylidene)isoindol-2-ium-2-yl]heptyl]isoindol-2-ium-1,3-dione dibromide Openeye Name: 2-methyl-2-[7-(2-methyl-1,3-dioxo-isoindolin-2-ium-2-yl)heptyl]isoindolin-2-ium-1,3-dione dibromide CAS Name: 2-methyl-2-[7-(2-methyl-1,3-dioxo-2-isoindol-2-iumyl)heptyl]isoindol-2-ium-1,3-dione dibromide IUPAC Name: 2-methyl-2-[7-(2-methyl-1,3-dioxoisoindol-2-ium-2-yl)heptyl]isoindol-2-ium-1,3-dione dibromide Traditional Name: 2-[7-(1,3-diketo-2-methyl-isoindolin-2-ium-2-yl)heptyl]-2-methyl-isoindolin-2-ium-1,3-quinone dibromide Formula: C25H28Br2N2O4 MolecularWeight: 580.30882

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C(=O)C2=CC=CC=C2C1=O)CCCCCCC[N+]3(C(=O)C4=CC=CC=C4C3=O)C.[Br-].[Br-]

Isomeric SMILES

C[N+]1(C(=O)C2=CC=CC=C2C1=O)CCCCCCC[N+]3(C(=O)C4=CC=CC=C4C3=O)C.[Br-].[Br-]

InChI

InChI=1S/C25H28N2O4.2BrH/c1-26(22(28)18-12-6-7-13-19(18)23(26)29)16-10-4-3-5-11-17-27(2)24(30)20-14-8-9-15-21(20)25(27)31;;/h6-9,12-15H,3-5,10-11,16-17H2,1-2H3;2*1H/q+2;;/p-2