[(S)-(5-bromanyl-1-benzofuran-2-yl)-(3-fluoranyl-4-methoxy-phenyl)methyl]azanium

Systemtic Name: [(S)-(5-bromanyl-1-benzofuran-2-yl)-(3-fluoranyl-4-methoxy-phenyl)methyl]azanium Openeye Name: [(S)-(5-bromobenzofuran-2-yl)-(3-fluoro-4-methoxy-phenyl)methyl]ammonium CAS Name: [(S)-(5-bromo-2-benzofuranyl)-(3-fluoro-4-methoxyphenyl)methyl]ammonium IUPAC Name: [(S)-(5-bromo-1-benzofuran-2-yl)-(3-fluoro-4-methoxyphenyl)methyl]azanium Traditional Name: [(S)-(5-bromobenzofuran-2-yl)-(3-fluoro-4-methoxy-phenyl)methyl]ammonium Formula: C16H14BrFNO2+ MolecularWeight: 351.190263

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C2=CC3=C(O2)C=CC(=C3)Br)[NH3+])F

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H](C2=CC3=C(O2)C=CC(=C3)Br)[NH3+])F

InChI

InChI=1S/C16H13BrFNO2/c1-20-14-4-2-9(7-12(14)18)16(19)15-8-10-6-11(17)3-5-13(10)21-15/h2-8,16H,19H2,1H3/p+1/t16-/m0/s1