1-pyridin-1-ium-2-yl-4-[[4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]phenyl]methyl]piperazin-4-ium

Systemtic Name: 1-pyridin-1-ium-2-yl-4-[[4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]phenyl]methyl]piperazin-4-ium Openeye Name: 1-pyridin-1-ium-2-yl-4-[[4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]phenyl]methyl]piperazin-4-ium CAS Name: 1-(2-pyridin-1-iumyl)-4-[[4-[[4-(2-pyridin-1-iumyl)-1-piperazin-1-iumyl]methyl]phenyl]methyl]piperazin-4-ium IUPAC Name: 1-pyridin-1-ium-2-yl-4-[[4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]phenyl]methyl]piperazin-4-ium Traditional Name: 1-pyridin-1-ium-2-yl-4-[4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]benzyl]piperazin-4-ium Formula: C26H36N6+4 MolecularWeight: 432.60424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)C[NH+]3CCN(CC3)C4=CC=CC=[NH+]4)C5=CC=CC=[NH+]5

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)C[NH+]3CCN(CC3)C4=CC=CC=[NH+]4)C5=CC=CC=[NH+]5

InChI

InChI=1S/C26H32N6/c1-3-11-27-25(5-1)31-17-13-29(14-18-31)21-23-7-9-24(10-8-23)22-30-15-19-32(20-16-30)26-6-2-4-12-28-26/h1-12H,13-22H2/p+4