1-[12-(2-azanyl-4-methyl-pyridin-1-ium-1-yl)dodecyl]-4-methyl-pyridin-1-ium-2-amine dibromide

Systemtic Name: 1-[12-(2-azanyl-4-methyl-pyridin-1-ium-1-yl)dodecyl]-4-methyl-pyridin-1-ium-2-amine dibromide Openeye Name: 1-[12-(2-amino-4-methyl-pyridin-1-ium-1-yl)dodecyl]-4-methyl-pyridin-1-ium-2-amine dibromide CAS Name: 1-[12-(2-amino-4-methyl-1-pyridin-1-iumyl)dodecyl]-4-methyl-2-pyridin-1-iumamine dibromide IUPAC Name: 1-[12-(2-amino-4-methylpyridin-1-ium-1-yl)dodecyl]-4-methylpyridin-1-ium-2-amine dibromide Traditional Name: [1-[12-(2-amino-4-methyl-pyridin-1-ium-1-yl)dodecyl]-4-methyl-pyridin-1-ium-2-yl]amine dibromide Formula: C24H40Br2N4 MolecularWeight: 544.4092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](C=C1)CCCCCCCCCCCC[N+]2=C(C=C(C=C2)C)N)N.[Br-].[Br-]

Isomeric SMILES

CC1=CC(=[N+](C=C1)CCCCCCCCCCCC[N+]2=C(C=C(C=C2)C)N)N.[Br-].[Br-]

InChI

InChI=1S/C24H38N4.2BrH/c1-21-13-17-27(23(25)19-21)15-11-9-7-5-3-4-6-8-10-12-16-28-18-14-22(2)20-24(28)26;;/h13-14,17-20,25-26H,3-12,15-16H2,1-2H3;2*1H