(5-bromanyl-2,4-dimethoxy-phenyl)methyl-[2-(4-fluorophenyl)ethyl]azanium

Systemtic Name: (5-bromanyl-2,4-dimethoxy-phenyl)methyl-[2-(4-fluorophenyl)ethyl]azanium Openeye Name: (5-bromo-2,4-dimethoxy-phenyl)methyl-[2-(4-fluorophenyl)ethyl]ammonium CAS Name: (5-bromo-2,4-dimethoxyphenyl)methyl-[2-(4-fluorophenyl)ethyl]ammonium IUPAC Name: (5-bromo-2,4-dimethoxyphenyl)methyl-[2-(4-fluorophenyl)ethyl]azanium Traditional Name: (5-bromo-2,4-dimethoxy-benzyl)-[2-(4-fluorophenyl)ethyl]ammonium Formula: C17H20BrFNO2+ MolecularWeight: 369.248603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C[NH2+]CCC2=CC=C(C=C2)F)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1C[NH2+]CCC2=CC=C(C=C2)F)Br)OC

InChI

InChI=1S/C17H19BrFNO2/c1-21-16-10-17(22-2)15(18)9-13(16)11-20-8-7-12-3-5-14(19)6-4-12/h3-6,9-10,20H,7-8,11H2,1-2H3/p+1