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

Systemtic Name: [5-bromanyl-2-[(2-fluorophenyl)methoxy]phenyl]methyl-(pyridin-4-ylmethyl)azanium Openeye Name: [5-bromo-2-[(2-fluorophenyl)methoxy]phenyl]methyl-(4-pyridylmethyl)ammonium CAS Name: [5-bromo-2-[(2-fluorophenyl)methoxy]phenyl]methyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: [5-bromo-2-[(2-fluorophenyl)methoxy]phenyl]methyl-(pyridin-4-ylmethyl)azanium Traditional Name: [5-bromo-2-(2-fluorobenzyl)oxy-benzyl]-(4-pyridylmethyl)ammonium Formula: C20H19BrFN2O+ MolecularWeight: 402.280063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC2=C(C=C(C=C2)Br)C[NH2+]CC3=CC=NC=C3)F

Isomeric SMILES

C1=CC=C(C(=C1)COC2=C(C=C(C=C2)Br)C[NH2+]CC3=CC=NC=C3)F

InChI

InChI=1S/C20H18BrFN2O/c21-18-5-6-20(25-14-16-3-1-2-4-19(16)22)17(11-18)13-24-12-15-7-9-23-10-8-15/h1-11,24H,12-14H2/p+1