4-piperidin-1-yl-1-[[3-[3-[(4-piperidin-1-ylpyridin-1-ium-1-yl)methyl]phenyl]phenyl]methyl]pyridin-1-ium dibromide

Systemtic Name: 4-piperidin-1-yl-1-[[3-[3-[(4-piperidin-1-ylpyridin-1-ium-1-yl)methyl]phenyl]phenyl]methyl]pyridin-1-ium dibromide Openeye Name: 4-(1-piperidyl)-1-[[3-[3-[[4-(1-piperidyl)pyridin-1-ium-1-yl]methyl]phenyl]phenyl]methyl]pyridin-1-ium dibromide CAS Name: 4-(1-piperidinyl)-1-[[3-[3-[[4-(1-piperidinyl)-1-pyridin-1-iumyl]methyl]phenyl]phenyl]methyl]pyridin-1-ium dibromide IUPAC Name: 4-piperidin-1-yl-1-[[3-[3-[(4-piperidin-1-ylpyridin-1-ium-1-yl)methyl]phenyl]phenyl]methyl]pyridin-1-ium dibromide Traditional Name: 4-piperidino-1-[3-[3-[(4-piperidinopyridin-1-ium-1-yl)methyl]phenyl]benzyl]pyridin-1-ium dibromide Formula: C34H40Br2N4 MolecularWeight: 664.5162

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=[N+](C=C2)CC3=CC=CC(=C3)C4=CC(=CC=C4)C[N+]5=CC=C(C=C5)N6CCCCC6.[Br-].[Br-]

Isomeric SMILES

C1CCN(CC1)C2=CC=[N+](C=C2)CC3=CC=CC(=C3)C4=CC(=CC=C4)C[N+]5=CC=C(C=C5)N6CCCCC6.[Br-].[Br-]

InChI

InChI=1S/C34H40N4.2BrH/c1-3-17-37(18-4-1)33-13-21-35(22-14-33)27-29-9-7-11-31(25-29)32-12-8-10-30(26-32)28-36-23-15-34(16-24-36)38-19-5-2-6-20-38;;/h7-16,21-26H,1-6,17-20,27-28H2;2*1H/q+2;;/p-2