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

Systemtic Name: [3-bromanyl-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]methyl-(2-hydroxyethyl)azanium Openeye Name: [3-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]methyl-(2-hydroxyethyl)ammonium CAS Name: [3-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxyphenyl]methyl-(2-hydroxyethyl)ammonium IUPAC Name: [3-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxyphenyl]methyl-(2-hydroxyethyl)azanium Traditional Name: [3-bromo-4-(2-fluorobenzyl)oxy-5-methoxy-benzyl]-(2-hydroxyethyl)ammonium Formula: C17H20BrFNO3+ MolecularWeight: 385.248003

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]CCO)Br)OCC2=CC=CC=C2F

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]CCO)Br)OCC2=CC=CC=C2F

InChI

InChI=1S/C17H19BrFNO3/c1-22-16-9-12(10-20-6-7-21)8-14(18)17(16)23-11-13-4-2-3-5-15(13)19/h2-5,8-9,20-21H,6-7,10-11H2,1H3/p+1