2-cyclobutyl-3-[1-(1-phenethylpiperidin-4-yl)piperidin-1-ium-4-yl]imidazo[4,5-b]pyridine

Systemtic Name: 2-cyclobutyl-3-[1-(1-phenethylpiperidin-4-yl)piperidin-1-ium-4-yl]imidazo[4,5-b]pyridine Openeye Name: 2-cyclobutyl-3-[1-(1-phenethyl-4-piperidyl)piperidin-1-ium-4-yl]imidazo[4,5-b]pyridine CAS Name: 2-cyclobutyl-3-[1-(1-phenethyl-4-piperidinyl)-4-piperidin-1-iumyl]imidazo[4,5-b]pyridine IUPAC Name: 2-cyclobutyl-3-[1-(1-phenethylpiperidin-4-yl)piperidin-1-ium-4-yl]imidazo[4,5-b]pyridine Traditional Name: 2-cyclobutyl-3-[1-(1-phenethyl-4-piperidyl)piperidin-1-ium-4-yl]imidazo[4,5-b]pyridine Formula: C28H38N5+ MolecularWeight: 444.63482

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C2=NC3=C(N2C4CC[NH+](CC4)C5CCN(CC5)CCC6=CC=CC=C6)N=CC=C3

Isomeric SMILES

C1CC(C1)C2=NC3=C(N2C4CC[NH+](CC4)C5CCN(CC5)CCC6=CC=CC=C6)N=CC=C3

InChI

InChI=1S/C28H37N5/c1-2-6-22(7-3-1)11-17-31-18-12-24(13-19-31)32-20-14-25(15-21-32)33-27(23-8-4-9-23)30-26-10-5-16-29-28(26)33/h1-3,5-7,10,16,23-25H,4,8-9,11-15,17-21H2/p+1