[4-(2-cyanophenyl)phenyl]methyl-[2-(2-fluoranylphenoxy)ethyl]-methyl-azanium

Systemtic Name: [4-(2-cyanophenyl)phenyl]methyl-[2-(2-fluoranylphenoxy)ethyl]-methyl-azanium Openeye Name: [4-(2-cyanophenyl)phenyl]methyl-[2-(2-fluorophenoxy)ethyl]-methyl-ammonium CAS Name: [4-(2-cyanophenyl)phenyl]methyl-[2-(2-fluorophenoxy)ethyl]-methylammonium IUPAC Name: [4-(2-cyanophenyl)phenyl]methyl-[2-(2-fluorophenoxy)ethyl]-methylazanium Traditional Name: [4-(2-cyanophenyl)benzyl]-[2-(2-fluorophenoxy)ethyl]-methyl-ammonium Formula: C23H22FN2O+ MolecularWeight: 361.431983

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCOC1=CC=CC=C1F)CC2=CC=C(C=C2)C3=CC=CC=C3C#N

Isomeric SMILES

C[NH+](CCOC1=CC=CC=C1F)CC2=CC=C(C=C2)C3=CC=CC=C3C#N

InChI

InChI=1S/C23H21FN2O/c1-26(14-15-27-23-9-5-4-8-22(23)24)17-18-10-12-19(13-11-18)21-7-3-2-6-20(21)16-25/h2-13H,14-15,17H2,1H3/p+1