[(1S)-1-[2-fluoranyl-6-(4-methyl-1,4-diazepan-4-ium-1-yl)phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[2-fluoranyl-6-(4-methyl-1,4-diazepan-4-ium-1-yl)phenyl]ethyl]azanium Openeye Name: [(1S)-1-[2-fluoro-6-(4-methyl-1,4-diazepan-4-ium-1-yl)phenyl]ethyl]ammonium CAS Name: [(1S)-1-[2-fluoro-6-(4-methyl-1,4-diazepan-4-ium-1-yl)phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[2-fluoro-6-(4-methyl-1,4-diazepan-4-ium-1-yl)phenyl]ethyl]azanium Traditional Name: [(1S)-1-[2-fluoro-6-(4-methyl-1,4-diazepan-4-ium-1-yl)phenyl]ethyl]ammonium Formula: C14H24FN3+2 MolecularWeight: 253.358863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC=C1F)N2CCC[NH+](CC2)C)[NH3+]

Isomeric SMILES

C[C@@H](C1=C(C=CC=C1F)N2CCC[NH+](CC2)C)[NH3+]

InChI

InChI=1S/C14H22FN3/c1-11(16)14-12(15)5-3-6-13(14)18-8-4-7-17(2)9-10-18/h3,5-6,11H,4,7-10,16H2,1-2H3/p+2/t11-/m0/s1