(5-bromanyl-2-methoxy-phenyl)methyl-[(5-cyano-2-fluoranyl-phenyl)methyl]-methyl-azanium

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl-[(5-cyano-2-fluoranyl-phenyl)methyl]-methyl-azanium Openeye Name: (5-bromo-2-methoxy-phenyl)methyl-[(5-cyano-2-fluoro-phenyl)methyl]-methyl-ammonium CAS Name: (5-bromo-2-methoxyphenyl)methyl-[(5-cyano-2-fluorophenyl)methyl]-methylammonium IUPAC Name: (5-bromo-2-methoxyphenyl)methyl-[(5-cyano-2-fluorophenyl)methyl]-methylazanium Traditional Name: (5-bromo-2-methoxy-benzyl)-(5-cyano-2-fluoro-benzyl)-methyl-ammonium Formula: C17H17BrFN2O+ MolecularWeight: 364.232083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrFN2O/c1-21(10-13-7-12(9-20)3-5-16(13)19)11-14-8-15(18)4-6-17(14)22-2/h3-8H,10-11H2,1-2H3/p+1