6-[(4-fluorophenyl)methylamino]-N-[[(2R)-oxolan-2-yl]methyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 6-[(4-fluorophenyl)methylamino]-N-[[(2R)-oxolan-2-yl]methyl]pyridin-1-ium-3-carboxamide Openeye Name: 6-[(4-fluorophenyl)methylamino]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]pyridin-1-ium-3-carboxamide CAS Name: 6-[(4-fluorophenyl)methylamino]-N-[[(2R)-2-oxolanyl]methyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 6-[(4-fluorophenyl)methylamino]-N-[[(2R)-oxolan-2-yl]methyl]pyridin-1-ium-3-carboxamide Traditional Name: 6-[(4-fluorobenzyl)amino]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]pyridin-1-ium-3-carboxamide Formula: C18H21FN3O2+ MolecularWeight: 330.376643

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=C[NH+]=C(C=C2)NCC3=CC=C(C=C3)F

Isomeric SMILES

C1C[C@@H](OC1)CNC(=O)C2=C[NH+]=C(C=C2)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H20FN3O2/c19-15-6-3-13(4-7-15)10-20-17-8-5-14(11-21-17)18(23)22-12-16-2-1-9-24-16/h3-8,11,16H,1-2,9-10,12H2,(H,20,21)(H,22,23)/p+1/t16-/m1/s1