4-[2,6-dimethyl-1-(phenylmethyl)pyridin-1-ium-4-yl]-2,6-dimethyl-1-(phenylmethyl)pyridin-1-ium dibromide

Systemtic Name: 4-[2,6-dimethyl-1-(phenylmethyl)pyridin-1-ium-4-yl]-2,6-dimethyl-1-(phenylmethyl)pyridin-1-ium dibromide Openeye Name: 1-benzyl-4-(1-benzyl-2,6-dimethyl-pyridin-1-ium-4-yl)-2,6-dimethyl-pyridin-1-ium dibromide CAS Name: 4-[2,6-dimethyl-1-(phenylmethyl)-4-pyridin-1-iumyl]-2,6-dimethyl-1-(phenylmethyl)pyridin-1-ium dibromide IUPAC Name: 1-benzyl-4-(1-benzyl-2,6-dimethylpyridin-1-ium-4-yl)-2,6-dimethylpyridin-1-ium dibromide Traditional Name: 1-benzyl-4-(1-benzyl-2,6-dimethyl-pyridin-1-ium-4-yl)-2,6-dimethyl-pyridin-1-ium dibromide Formula: C28H30Br2N2 MolecularWeight: 554.3592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=[N+]1CC2=CC=CC=C2)C)C3=CC(=[N+](C(=C3)C)CC4=CC=CC=C4)C.[Br-].[Br-]

Isomeric SMILES

CC1=CC(=CC(=[N+]1CC2=CC=CC=C2)C)C3=CC(=[N+](C(=C3)C)CC4=CC=CC=C4)C.[Br-].[Br-]

InChI

InChI=1S/C28H30N2.2BrH/c1-21-15-27(16-22(2)29(21)19-25-11-7-5-8-12-25)28-17-23(3)30(24(4)18-28)20-26-13-9-6-10-14-26;;/h5-18H,19-20H2,1-4H3;2*1H/q+2;;/p-2