1-[5-[3,5-bis[5-(2-methylpyridin-1-ium-1-yl)pentyl]phenyl]pentyl]-2-methyl-pyridin-1-ium

Systemtic Name: 1-[5-[3,5-bis[5-(2-methylpyridin-1-ium-1-yl)pentyl]phenyl]pentyl]-2-methyl-pyridin-1-ium Openeye Name: 1-[5-[3,5-bis[5-(2-methylpyridin-1-ium-1-yl)pentyl]phenyl]pentyl]-2-methyl-pyridin-1-ium CAS Name: 1-[5-[3,5-bis[5-(2-methyl-1-pyridin-1-iumyl)pentyl]phenyl]pentyl]-2-methylpyridin-1-ium IUPAC Name: 1-[5-[3,5-bis[5-(2-methylpyridin-1-ium-1-yl)pentyl]phenyl]pentyl]-2-methylpyridin-1-ium Traditional Name: 1-[5-[3,5-bis[5-(2-methylpyridin-1-ium-1-yl)pentyl]phenyl]pentyl]-2-methyl-pyridin-1-ium Formula: C39H54N3+3 MolecularWeight: 564.86616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=[N+]1CCCCCC2=CC(=CC(=C2)CCCCC[N+]3=CC=CC=C3C)CCCCC[N+]4=CC=CC=C4C

Isomeric SMILES

CC1=CC=CC=[N+]1CCCCCC2=CC(=CC(=C2)CCCCC[N+]3=CC=CC=C3C)CCCCC[N+]4=CC=CC=C4C

InChI

InChI=1S/C39H54N3/c1-34-19-10-16-28-40(34)25-13-4-7-22-37-31-38(23-8-5-14-26-41-29-17-11-20-35(41)2)33-39(32-37)24-9-6-15-27-42-30-18-12-21-36(42)3/h10-12,16-21,28-33H,4-9,13-15,22-27H2,1-3H3/q+3