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

Systemtic Name: (3-ethanoylphenyl)methyl-[[1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-methyl-azanium Openeye Name: (3-acetylphenyl)methyl-[[1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-methyl-ammonium CAS Name: (3-acetylphenyl)methyl-[[1-[2-(4-methoxyphenyl)ethyl]-4-piperidin-1-iumyl]methyl]-methylammonium IUPAC Name: (3-acetylphenyl)methyl-[[1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-methylazanium Traditional Name: (3-acetylbenzyl)-[[1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-methyl-ammonium Formula: C25H36N2O2+2 MolecularWeight: 396.56554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)C[NH+](C)CC2CC[NH+](CC2)CCC3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)C[NH+](C)CC2CC[NH+](CC2)CCC3=CC=C(C=C3)OC

InChI

InChI=1S/C25H34N2O2/c1-20(28)24-6-4-5-23(17-24)19-26(2)18-22-12-15-27(16-13-22)14-11-21-7-9-25(29-3)10-8-21/h4-10,17,22H,11-16,18-19H2,1-3H3/p+2