[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl-methyl-(quinolin-8-ylmethyl)azanium

Systemtic Name: [(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl-methyl-(quinolin-8-ylmethyl)azanium Openeye Name: [(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl-methyl-(8-quinolylmethyl)ammonium CAS Name: [(3R)-1-[2-(4-methoxyphenyl)ethyl]-3-piperidin-1-iumyl]methyl-methyl-(8-quinolinylmethyl)ammonium IUPAC Name: [(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl-methyl-(quinolin-8-ylmethyl)azanium Traditional Name: [(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl-methyl-(8-quinolylmethyl)ammonium Formula: C26H35N3O+2 MolecularWeight: 405.5756

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1CCC[NH+](C1)CCC2=CC=C(C=C2)OC)CC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C[NH+](C[C@H]1CCC[NH+](C1)CCC2=CC=C(C=C2)OC)CC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C26H33N3O/c1-28(20-24-8-3-7-23-9-4-15-27-26(23)24)18-22-6-5-16-29(19-22)17-14-21-10-12-25(30-2)13-11-21/h3-4,7-13,15,22H,5-6,14,16-20H2,1-2H3/p+2/t22-/m1/s1