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

Systemtic Name: [1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl-methyl-[(1-pyridin-3-ylpyrrol-2-yl)methyl]azanium Openeye Name: [1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl-methyl-[[1-(3-pyridyl)pyrrol-2-yl]methyl]ammonium CAS Name: [1-[2-(4-methoxyphenyl)ethyl]-4-piperidin-1-iumyl]methyl-methyl-[[1-(3-pyridinyl)-2-pyrrolyl]methyl]ammonium IUPAC Name: [1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl-methyl-[(1-pyridin-3-ylpyrrol-2-yl)methyl]azanium Traditional Name: [1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl-methyl-[[1-(3-pyridyl)pyrrol-2-yl]methyl]ammonium Formula: C26H36N4O+2 MolecularWeight: 420.59024

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1CC[NH+](CC1)CCC2=CC=C(C=C2)OC)CC3=CC=CN3C4=CN=CC=C4

Isomeric SMILES

C[NH+](CC1CC[NH+](CC1)CCC2=CC=C(C=C2)OC)CC3=CC=CN3C4=CN=CC=C4

InChI

InChI=1S/C26H34N4O/c1-28(21-25-6-4-15-30(25)24-5-3-14-27-19-24)20-23-12-17-29(18-13-23)16-11-22-7-9-26(31-2)10-8-22/h3-10,14-15,19,23H,11-13,16-18,20-21H2,1-2H3/p+2