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

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

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1CC[NH+](CC1)CCC2=CC=C(C=C2)OC)CC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C[NH+](CC1CC[NH+](CC1)CCC2=CC=C(C=C2)OC)CC3=CC=CC4=C3N=CC=C4

InChI

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