[4-(2-cyanophenyl)phenyl]methyl-[(3-fluorophenyl)methyl]-methyl-azanium

Systemtic Name: [4-(2-cyanophenyl)phenyl]methyl-[(3-fluorophenyl)methyl]-methyl-azanium Openeye Name: [4-(2-cyanophenyl)phenyl]methyl-[(3-fluorophenyl)methyl]-methyl-ammonium CAS Name: [4-(2-cyanophenyl)phenyl]methyl-[(3-fluorophenyl)methyl]-methylammonium IUPAC Name: [4-(2-cyanophenyl)phenyl]methyl-[(3-fluorophenyl)methyl]-methylazanium Traditional Name: [4-(2-cyanophenyl)benzyl]-(3-fluorobenzyl)-methyl-ammonium Formula: C22H20FN2+ MolecularWeight: 331.406003

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)C2=CC=CC=C2C#N)CC3=CC(=CC=C3)F

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)C2=CC=CC=C2C#N)CC3=CC(=CC=C3)F

InChI

InChI=1S/C22H19FN2/c1-25(16-18-5-4-7-21(23)13-18)15-17-9-11-19(12-10-17)22-8-3-2-6-20(22)14-24/h2-13H,15-16H2,1H3/p+1