1-[(4-fluorophenyl)methyl]azepan-1-ium

Systemtic Name: 1-[(4-fluorophenyl)methyl]azepan-1-ium Openeye Name: 1-[(4-fluorophenyl)methyl]azepan-1-ium CAS Name: 1-[(4-fluorophenyl)methyl]azepan-1-ium IUPAC Name: 1-[(4-fluorophenyl)methyl]azepan-1-ium Traditional Name: 1-(4-fluorobenzyl)azepan-1-ium Formula: C13H19FN+ MolecularWeight: 208.295063

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CC2=CC=C(C=C2)F

Isomeric SMILES

C1CCC[NH+](CC1)CC2=CC=C(C=C2)F

InChI

InChI=1S/C13H18FN/c14-13-7-5-12(6-8-13)11-15-9-3-1-2-4-10-15/h5-8H,1-4,9-11H2/p+1