(1-cyclopentylpiperidin-1-ium-4-yl)methyl-[[(2R)-oxolan-2-yl]methyl]-[(1-pyridin-2-ylpyrrol-2-yl)methyl]azanium

Systemtic Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-[[(2R)-oxolan-2-yl]methyl]-[(1-pyridin-2-ylpyrrol-2-yl)methyl]azanium Openeye Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-[[1-(2-pyridyl)pyrrol-2-yl]methyl]-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium CAS Name: (1-cyclopentyl-4-piperidin-1-iumyl)methyl-[[(2R)-2-oxolanyl]methyl]-[[1-(2-pyridinyl)-2-pyrrolyl]methyl]ammonium IUPAC Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-[[(2R)-oxolan-2-yl]methyl]-[(1-pyridin-2-ylpyrrol-2-yl)methyl]azanium Traditional Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-[[1-(2-pyridyl)pyrrol-2-yl]methyl]-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium Formula: C26H40N4O+2 MolecularWeight: 424.622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCC(CC2)C[NH+](CC3CCCO3)CC4=CC=CN4C5=CC=CC=N5

Isomeric SMILES

C1CCC(C1)[NH+]2CCC(CC2)C[NH+](C[C@H]3CCCO3)CC4=CC=CN4C5=CC=CC=N5

InChI

InChI=1S/C26H38N4O/c1-2-8-23(7-1)29-16-12-22(13-17-29)19-28(21-25-10-6-18-31-25)20-24-9-5-15-30(24)26-11-3-4-14-27-26/h3-5,9,11,14-15,22-23,25H,1-2,6-8,10,12-13,16-21H2/p+2/t25-/m1/s1