3-oxidanidyl-3-[1-(1-phenylcyclododecyl)piperidin-4-yl]-1,2-dihydrobenzimidazol-3-ium

Systemtic Name: 3-oxidanidyl-3-[1-(1-phenylcyclododecyl)piperidin-4-yl]-1,2-dihydrobenzimidazol-3-ium Openeye Name: 3-oxido-3-[1-(1-phenylcyclododecyl)-4-piperidyl]-1,2-dihydrobenzimidazol-3-ium CAS Name: 3-oxido-3-[1-(1-phenylcyclododecyl)-4-piperidinyl]-1,2-dihydrobenzimidazol-3-ium IUPAC Name: 3-oxido-3-[1-(1-phenylcyclododecyl)piperidin-4-yl]-1,2-dihydrobenzimidazol-3-ium Traditional Name: 3-oxido-3-[1-(1-phenylcyclododecyl)-4-piperidyl]-1,2-dihydrobenzimidazol-3-ium Formula: C30H43N3O MolecularWeight: 461.68192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCC(CCCCC1)(C2=CC=CC=C2)N3CCC(CC3)[N+]4(CNC5=CC=CC=C54)[O-]

Isomeric SMILES

C1CCCCCC(CCCCC1)(C2=CC=CC=C2)N3CCC(CC3)[N+]4(CNC5=CC=CC=C54)[O-]

InChI

InChI=1S/C30H43N3O/c34-33(25-31-28-17-11-12-18-29(28)33)27-19-23-32(24-20-27)30(26-15-9-8-10-16-26)21-13-6-4-2-1-3-5-7-14-22-30/h8-12,15-18,27,31H,1-7,13-14,19-25H2