[5-bromanyl-2-[(2-fluorophenyl)methoxy]phenyl]methyl-(4-oxidanylbutyl)azanium

Systemtic Name: [5-bromanyl-2-[(2-fluorophenyl)methoxy]phenyl]methyl-(4-oxidanylbutyl)azanium Openeye Name: [5-bromo-2-[(2-fluorophenyl)methoxy]phenyl]methyl-(4-hydroxybutyl)ammonium CAS Name: [5-bromo-2-[(2-fluorophenyl)methoxy]phenyl]methyl-(4-hydroxybutyl)ammonium IUPAC Name: [5-bromo-2-[(2-fluorophenyl)methoxy]phenyl]methyl-(4-hydroxybutyl)azanium Traditional Name: [5-bromo-2-(2-fluorobenzyl)oxy-benzyl]-(4-hydroxybutyl)ammonium Formula: C18H22BrFNO2+ MolecularWeight: 383.275183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC2=C(C=C(C=C2)Br)C[NH2+]CCCCO)F

Isomeric SMILES

C1=CC=C(C(=C1)COC2=C(C=C(C=C2)Br)C[NH2+]CCCCO)F

InChI

InChI=1S/C18H21BrFNO2/c19-16-7-8-18(15(11-16)12-21-9-3-4-10-22)23-13-14-5-1-2-6-17(14)20/h1-2,5-8,11,21-22H,3-4,9-10,12-13H2/p+1