[5-(azaniumylmethyl)-2-fluoranyl-phenyl]methyl-methyl-(phenylmethyl)azanium

Systemtic Name: [5-(azaniumylmethyl)-2-fluoranyl-phenyl]methyl-methyl-(phenylmethyl)azanium Openeye Name: [5-(azaniumylmethyl)-2-fluoro-phenyl]methyl-benzyl-methyl-ammonium CAS Name: [5-(ammoniomethyl)-2-fluorophenyl]methyl-methyl-(phenylmethyl)ammonium IUPAC Name: [5-(azaniumylmethyl)-2-fluorophenyl]methyl-benzyl-methylazanium Traditional Name: [5-(ammoniomethyl)-2-fluoro-benzyl]-benzyl-methyl-ammonium Formula: C16H21FN2+2 MolecularWeight: 260.349743

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC2=C(C=CC(=C2)C[NH3+])F

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC2=C(C=CC(=C2)C[NH3+])F

InChI

InChI=1S/C16H19FN2/c1-19(11-13-5-3-2-4-6-13)12-15-9-14(10-18)7-8-16(15)17/h2-9H,10-12,18H2,1H3/p+2