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

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

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)CC(C2=CC=C(C=C2)F)[NH3+]

Isomeric SMILES

C[NH+]1CCCN(CC1)C[C@H](C2=CC=C(C=C2)F)[NH3+]

InChI

InChI=1S/C14H22FN3/c1-17-7-2-8-18(10-9-17)11-14(16)12-3-5-13(15)6-4-12/h3-6,14H,2,7-11,16H2,1H3/p+2/t14-/m1/s1