(4-bromophenyl)methyl-[(5-cyano-2-fluoranyl-phenyl)methyl]-methyl-azanium

Systemtic Name: (4-bromophenyl)methyl-[(5-cyano-2-fluoranyl-phenyl)methyl]-methyl-azanium Openeye Name: (4-bromophenyl)methyl-[(5-cyano-2-fluoro-phenyl)methyl]-methyl-ammonium CAS Name: (4-bromophenyl)methyl-[(5-cyano-2-fluorophenyl)methyl]-methylammonium IUPAC Name: (4-bromophenyl)methyl-[(5-cyano-2-fluorophenyl)methyl]-methylazanium Traditional Name: (4-bromobenzyl)-(5-cyano-2-fluoro-benzyl)-methyl-ammonium Formula: C16H15BrFN2+ MolecularWeight: 334.206103

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)Br)CC2=C(C=CC(=C2)C#N)F

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)Br)CC2=C(C=CC(=C2)C#N)F

InChI

InChI=1S/C16H14BrFN2/c1-20(10-12-2-5-15(17)6-3-12)11-14-8-13(9-19)4-7-16(14)18/h2-8H,10-11H2,1H3/p+1