5-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]phenanthridin-5-ium

Systemtic Name: 5-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]phenanthridin-5-ium Openeye Name: 5-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]phenanthridin-5-ium CAS Name: 5-[3-(1-methyl-1-pyrrolidin-1-iumyl)propyl]phenanthridin-5-ium IUPAC Name: 5-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]phenanthridin-5-ium Traditional Name: 5-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]phenanthridin-5-ium Formula: C21H26N2+2 MolecularWeight: 306.44454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC1)CCC[N+]2=CC3=CC=CC=C3C4=CC=CC=C42

Isomeric SMILES

C[N+]1(CCCC1)CCC[N+]2=CC3=CC=CC=C3C4=CC=CC=C42

InChI

InChI=1S/C21H26N2/c1-23(14-6-7-15-23)16-8-13-22-17-18-9-2-3-10-19(18)20-11-4-5-12-21(20)22/h2-5,9-12,17H,6-8,13-16H2,1H3/q+2