[(1S)-1-[4-(azocan-1-yl)-3-fluoranyl-phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[4-(azocan-1-yl)-3-fluoranyl-phenyl]ethyl]azanium Openeye Name: [(1S)-1-[4-(azocan-1-yl)-3-fluoro-phenyl]ethyl]ammonium CAS Name: [(1S)-1-[4-(1-azocanyl)-3-fluorophenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[4-(azocan-1-yl)-3-fluorophenyl]ethyl]azanium Traditional Name: [(1S)-1-[4-(azocan-1-yl)-3-fluoro-phenyl]ethyl]ammonium Formula: C15H24FN2+ MolecularWeight: 251.362863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)N2CCCCCCC2)F)[NH3+]

Isomeric SMILES

C[C@@H](C1=CC(=C(C=C1)N2CCCCCCC2)F)[NH3+]

InChI

InChI=1S/C15H23FN2/c1-12(17)13-7-8-15(14(16)11-13)18-9-5-3-2-4-6-10-18/h7-8,11-12H,2-6,9-10,17H2,1H3/p+1/t12-/m0/s1