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

Systemtic Name: [(1S)-1-[4-(azepan-1-yl)-3-fluoranyl-phenyl]ethyl]-cyclopropyl-azanium Openeye Name: [(1S)-1-[4-(azepan-1-yl)-3-fluoro-phenyl]ethyl]-cyclopropyl-ammonium CAS Name: [(1S)-1-[4-(1-azepanyl)-3-fluorophenyl]ethyl]-cyclopropylammonium IUPAC Name: [(1S)-1-[4-(azepan-1-yl)-3-fluorophenyl]ethyl]-cyclopropylazanium Traditional Name: [(1S)-1-[4-(azepan-1-yl)-3-fluoro-phenyl]ethyl]-cyclopropyl-ammonium Formula: C17H26FN2+ MolecularWeight: 277.400143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)N2CCCCCC2)F)[NH2+]C3CC3

Isomeric SMILES

C[C@@H](C1=CC(=C(C=C1)N2CCCCCC2)F)[NH2+]C3CC3

InChI

InChI=1S/C17H25FN2/c1-13(19-15-7-8-15)14-6-9-17(16(18)12-14)20-10-4-2-3-5-11-20/h6,9,12-13,15,19H,2-5,7-8,10-11H2,1H3/p+1/t13-/m0/s1