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

Systemtic Name: [5-(azaniumylmethyl)-2-fluoranyl-phenyl]methyl-ethyl-(phenylmethyl)azanium Openeye Name: [5-(azaniumylmethyl)-2-fluoro-phenyl]methyl-benzyl-ethyl-ammonium CAS Name: [5-(ammoniomethyl)-2-fluorophenyl]methyl-ethyl-(phenylmethyl)ammonium IUPAC Name: [5-(azaniumylmethyl)-2-fluorophenyl]methyl-benzyl-ethylazanium Traditional Name: [5-(ammoniomethyl)-2-fluoro-benzyl]-benzyl-ethyl-ammonium Formula: C17H23FN2+2 MolecularWeight: 274.376323

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21FN2/c1-2-20(12-14-6-4-3-5-7-14)13-16-10-15(11-19)8-9-17(16)18/h3-10H,2,11-13,19H2,1H3/p+2