[4-(2-bromanylphenoxy)-3-fluoranyl-phenyl]methylazanium

Systemtic Name: [4-(2-bromanylphenoxy)-3-fluoranyl-phenyl]methylazanium Openeye Name: [4-(2-bromophenoxy)-3-fluoro-phenyl]methylammonium CAS Name: [4-(2-bromophenoxy)-3-fluorophenyl]methylammonium IUPAC Name: [4-(2-bromophenoxy)-3-fluorophenyl]methylazanium Traditional Name: [4-(2-bromophenoxy)-3-fluoro-benzyl]ammonium Formula: C13H12BrFNO+ MolecularWeight: 297.142883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OC2=C(C=C(C=C2)C[NH3+])F)Br

Isomeric SMILES

C1=CC=C(C(=C1)OC2=C(C=C(C=C2)C[NH3+])F)Br

InChI

InChI=1S/C13H11BrFNO/c14-10-3-1-2-4-12(10)17-13-6-5-9(8-16)7-11(13)15/h1-7H,8,16H2/p+1