3-methyl-1-[1-[4-[1-(3-methylpyridin-1-ium-1-yl)butyl]phenyl]butyl]pyridin-1-ium dibromide

Systemtic Name: 3-methyl-1-[1-[4-[1-(3-methylpyridin-1-ium-1-yl)butyl]phenyl]butyl]pyridin-1-ium dibromide Openeye Name: 3-methyl-1-[1-[4-[1-(3-methylpyridin-1-ium-1-yl)butyl]phenyl]butyl]pyridin-1-ium dibromide CAS Name: 3-methyl-1-[1-[4-[1-(3-methyl-1-pyridin-1-iumyl)butyl]phenyl]butyl]pyridin-1-ium dibromide IUPAC Name: 3-methyl-1-[1-[4-[1-(3-methylpyridin-1-ium-1-yl)butyl]phenyl]butyl]pyridin-1-ium dibromide Traditional Name: 3-methyl-1-[1-[4-[1-(3-methylpyridin-1-ium-1-yl)butyl]phenyl]butyl]pyridin-1-ium dibromide Formula: C26H34Br2N2 MolecularWeight: 534.36956

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=C(C=C1)C(CCC)[N+]2=CC=CC(=C2)C)[N+]3=CC=CC(=C3)C.[Br-].[Br-]

Isomeric SMILES

CCCC(C1=CC=C(C=C1)C(CCC)[N+]2=CC=CC(=C2)C)[N+]3=CC=CC(=C3)C.[Br-].[Br-]

InChI

InChI=1S/C26H34N2.2BrH/c1-5-9-25(27-17-7-11-21(3)19-27)23-13-15-24(16-14-23)26(10-6-2)28-18-8-12-22(4)20-28;;/h7-8,11-20,25-26H,5-6,9-10H2,1-4H3;2*1H/q+2;;/p-2