[3-bromanyl-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]methyl-(2-methoxyethyl)azanium

Systemtic Name: [3-bromanyl-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]methyl-(2-methoxyethyl)azanium Openeye Name: [3-bromo-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]methyl-(2-methoxyethyl)ammonium CAS Name: [3-bromo-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]methyl-(2-methoxyethyl)ammonium IUPAC Name: [3-bromo-5-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]methyl-(2-methoxyethyl)azanium Traditional Name: [3-bromo-5-ethoxy-4-(4-fluorobenzyl)oxy-benzyl]-(2-methoxyethyl)ammonium Formula: C19H24BrFNO3+ MolecularWeight: 413.301163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]CCOC)Br)OCC2=CC=C(C=C2)F

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]CCOC)Br)OCC2=CC=C(C=C2)F

InChI

InChI=1S/C19H23BrFNO3/c1-3-24-18-11-15(12-22-8-9-23-2)10-17(20)19(18)25-13-14-4-6-16(21)7-5-14/h4-7,10-11,22H,3,8-9,12-13H2,1-2H3/p+1