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

Systemtic Name: (4-fluorophenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)-(pyridin-4-ylmethyl)azanium Openeye Name: (4-fluorophenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)-(4-pyridylmethyl)ammonium CAS Name: (4-fluorophenyl)methyl-[3-(4-morpholin-4-iumyl)propyl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: (4-fluorophenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)-(pyridin-4-ylmethyl)azanium Traditional Name: (4-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=C(C=C2)F)CC3=CC=NC=C3

Isomeric SMILES

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

InChI

InChI=1S/C20H26FN3O/c21-20-4-2-18(3-5-20)16-24(17-19-6-8-22-9-7-19)11-1-10-23-12-14-25-15-13-23/h2-9H,1,10-17H2/p+2