(3-fluorophenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)-(pyridin-4-ylmethyl)azanium

Systemtic Name: (3-fluorophenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)-(pyridin-4-ylmethyl)azanium Openeye Name: (3-fluorophenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)-(4-pyridylmethyl)ammonium CAS Name: (3-fluorophenyl)methyl-[3-(4-morpholin-4-iumyl)propyl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: (3-fluorophenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)-(pyridin-4-ylmethyl)azanium Traditional Name: (3-fluorobenzyl)-(3-morpholin-4-ium-4-ylpropyl)-(4-pyridylmethyl)ammonium Formula: C20H28FN3O+2 MolecularWeight: 345.454223

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCC[NH+](CC2=CC=NC=C2)CC3=CC(=CC=C3)F

Isomeric SMILES

C1COCC[NH+]1CCC[NH+](CC2=CC=NC=C2)CC3=CC(=CC=C3)F

InChI

InChI=1S/C20H26FN3O/c21-20-4-1-3-19(15-20)17-24(16-18-5-7-22-8-6-18)10-2-9-23-11-13-25-14-12-23/h1,3-8,15H,2,9-14,16-17H2/p+2