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

Systemtic Name: (3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-[(4-fluorophenyl)methyl]azanium Openeye Name: (3-bromo-4-hydroxy-5-methoxy-phenyl)methyl-[(4-fluorophenyl)methyl]ammonium CAS Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-[(4-fluorophenyl)methyl]ammonium IUPAC Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-[(4-fluorophenyl)methyl]azanium Traditional Name: (3-bromo-4-hydroxy-5-methoxy-benzyl)-(4-fluorobenzyl)ammonium Formula: C15H16BrFNO2+ MolecularWeight: 341.195443

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]CC2=CC=C(C=C2)F)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]CC2=CC=C(C=C2)F)Br)O

InChI

InChI=1S/C15H15BrFNO2/c1-20-14-7-11(6-13(16)15(14)19)9-18-8-10-2-4-12(17)5-3-10/h2-7,18-19H,8-9H2,1H3/p+1