[(1R)-1-[4-(azepan-1-yl)-3-fluoranyl-phenyl]ethyl]-propyl-azanium

Systemtic Name: [(1R)-1-[4-(azepan-1-yl)-3-fluoranyl-phenyl]ethyl]-propyl-azanium Openeye Name: [(1R)-1-[4-(azepan-1-yl)-3-fluoro-phenyl]ethyl]-propyl-ammonium CAS Name: [(1R)-1-[4-(1-azepanyl)-3-fluorophenyl]ethyl]-propylammonium IUPAC Name: [(1R)-1-[4-(azepan-1-yl)-3-fluorophenyl]ethyl]-propylazanium Traditional Name: [(1R)-1-[4-(azepan-1-yl)-3-fluoro-phenyl]ethyl]-propyl-ammonium Formula: C17H28FN2+ MolecularWeight: 279.416023

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]C(C)C1=CC(=C(C=C1)N2CCCCCC2)F

Isomeric SMILES

CCC[NH2+][C@H](C)C1=CC(=C(C=C1)N2CCCCCC2)F

InChI

InChI=1S/C17H27FN2/c1-3-10-19-14(2)15-8-9-17(16(18)13-15)20-11-6-4-5-7-12-20/h8-9,13-14,19H,3-7,10-12H2,1-2H3/p+1/t14-/m1/s1