[5-bromanyl-2-[(4-fluorophenyl)methoxy]phenyl]methyl-(3-morpholin-4-ylpropyl)azanium

Systemtic Name: [5-bromanyl-2-[(4-fluorophenyl)methoxy]phenyl]methyl-(3-morpholin-4-ylpropyl)azanium Openeye Name: [5-bromo-2-[(4-fluorophenyl)methoxy]phenyl]methyl-(3-morpholinopropyl)ammonium CAS Name: [5-bromo-2-[(4-fluorophenyl)methoxy]phenyl]methyl-[3-(4-morpholinyl)propyl]ammonium IUPAC Name: [5-bromo-2-[(4-fluorophenyl)methoxy]phenyl]methyl-(3-morpholin-4-ylpropyl)azanium Traditional Name: [5-bromo-2-(4-fluorobenzyl)oxy-benzyl]-(3-morpholinopropyl)ammonium Formula: C21H27BrFN2O2+ MolecularWeight: 438.353683

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCC[NH2+]CC2=C(C=CC(=C2)Br)OCC3=CC=C(C=C3)F

Isomeric SMILES

C1COCCN1CCC[NH2+]CC2=C(C=CC(=C2)Br)OCC3=CC=C(C=C3)F

InChI

InChI=1S/C21H26BrFN2O2/c22-19-4-7-21(27-16-17-2-5-20(23)6-3-17)18(14-19)15-24-8-1-9-25-10-12-26-13-11-25/h2-7,14,24H,1,8-13,15-16H2/p+1