(4-ethynylphenyl)methyl-[[1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-methyl-azanium

Systemtic Name: (4-ethynylphenyl)methyl-[[1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-methyl-azanium Openeye Name: (4-ethynylphenyl)methyl-[[1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-methyl-ammonium CAS Name: (4-ethynylphenyl)methyl-[[1-[2-(4-methoxyphenyl)ethyl]-4-piperidin-1-iumyl]methyl]-methylammonium IUPAC Name: (4-ethynylphenyl)methyl-[[1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-methylazanium Traditional Name: (4-ethynylbenzyl)-[[1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-methyl-ammonium Formula: C25H34N2O+2 MolecularWeight: 378.55026

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1CC[NH+](CC1)CCC2=CC=C(C=C2)OC)CC3=CC=C(C=C3)C#C

Isomeric SMILES

C[NH+](CC1CC[NH+](CC1)CCC2=CC=C(C=C2)OC)CC3=CC=C(C=C3)C#C

InChI

InChI=1S/C25H32N2O/c1-4-21-5-7-23(8-6-21)19-26(2)20-24-14-17-27(18-15-24)16-13-22-9-11-25(28-3)12-10-22/h1,5-12,24H,13-20H2,2-3H3/p+2