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

Systemtic Name: [(1R)-1-[4-(azepan-1-yl)-3-fluoranyl-phenyl]ethyl]-butyl-azanium Openeye Name: [(1R)-1-[4-(azepan-1-yl)-3-fluoro-phenyl]ethyl]-butyl-ammonium CAS Name: [(1R)-1-[4-(1-azepanyl)-3-fluorophenyl]ethyl]-butylammonium IUPAC Name: [(1R)-1-[4-(azepan-1-yl)-3-fluorophenyl]ethyl]-butylazanium Traditional Name: [(1R)-1-[4-(azepan-1-yl)-3-fluoro-phenyl]ethyl]-butyl-ammonium Formula: C18H30FN2+ MolecularWeight: 293.442603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29FN2/c1-3-4-11-20-15(2)16-9-10-18(17(19)14-16)21-12-7-5-6-8-13-21/h9-10,14-15,20H,3-8,11-13H2,1-2H3/p+1/t15-/m1/s1