(1-cyclopentylpiperidin-1-ium-4-yl)methyl-[(4-fluoranyl-3-methoxy-phenyl)methyl]-(pyridin-3-ylmethyl)azanium

Systemtic Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-[(4-fluoranyl-3-methoxy-phenyl)methyl]-(pyridin-3-ylmethyl)azanium Openeye Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-[(4-fluoro-3-methoxy-phenyl)methyl]-(3-pyridylmethyl)ammonium CAS Name: (1-cyclopentyl-4-piperidin-1-iumyl)methyl-[(4-fluoro-3-methoxyphenyl)methyl]-(3-pyridinylmethyl)ammonium IUPAC Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-[(4-fluoro-3-methoxyphenyl)methyl]-(pyridin-3-ylmethyl)azanium Traditional Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-(4-fluoro-3-methoxy-benzyl)-(3-pyridylmethyl)ammonium Formula: C25H36FN3O+2 MolecularWeight: 413.571243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH+](CC2CC[NH+](CC2)C3CCCC3)CC4=CN=CC=C4)F

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH+](CC2CC[NH+](CC2)C3CCCC3)CC4=CN=CC=C4)F

InChI

InChI=1S/C25H34FN3O/c1-30-25-15-21(8-9-24(25)26)18-28(19-22-5-4-12-27-16-22)17-20-10-13-29(14-11-20)23-6-2-3-7-23/h4-5,8-9,12,15-16,20,23H,2-3,6-7,10-11,13-14,17-19H2,1H3/p+2