1-[4-[[4-(2-pyrrolidin-1-ium-1-ylethyl)piperazin-1-ium-1-yl]methyl]phenyl]benzimidazole

Systemtic Name: 1-[4-[[4-(2-pyrrolidin-1-ium-1-ylethyl)piperazin-1-ium-1-yl]methyl]phenyl]benzimidazole Openeye Name: 1-[4-[[4-(2-pyrrolidin-1-ium-1-ylethyl)piperazin-1-ium-1-yl]methyl]phenyl]benzimidazole CAS Name: 1-[4-[[4-[2-(1-pyrrolidin-1-iumyl)ethyl]-1-piperazin-1-iumyl]methyl]phenyl]benzimidazole IUPAC Name: 1-[4-[[4-(2-pyrrolidin-1-ium-1-ylethyl)piperazin-1-ium-1-yl]methyl]phenyl]benzimidazole Traditional Name: 1-[4-[[4-(2-pyrrolidin-1-ium-1-ylethyl)piperazin-1-ium-1-yl]methyl]phenyl]benzimidazole Formula: C24H33N5+2 MolecularWeight: 391.55232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCN2CC[NH+](CC2)CC3=CC=C(C=C3)N4C=NC5=CC=CC=C54

Isomeric SMILES

C1CC[NH+](C1)CCN2CC[NH+](CC2)CC3=CC=C(C=C3)N4C=NC5=CC=CC=C54

InChI

InChI=1S/C24H31N5/c1-2-6-24-23(5-1)25-20-29(24)22-9-7-21(8-10-22)19-28-17-15-27(16-18-28)14-13-26-11-3-4-12-26/h1-2,5-10,20H,3-4,11-19H2/p+2