[(1R)-1-(3-fluoranyl-4-methoxy-phenyl)-2-[(2S)-octan-2-yl]oxy-ethyl]azanium

Systemtic Name: [(1R)-1-(3-fluoranyl-4-methoxy-phenyl)-2-[(2S)-octan-2-yl]oxy-ethyl]azanium Openeye Name: [(1R)-1-(3-fluoro-4-methoxy-phenyl)-2-[(1S)-1-methylheptoxy]ethyl]ammonium CAS Name: [(1R)-1-(3-fluoro-4-methoxyphenyl)-2-[(2S)-octan-2-yl]oxyethyl]ammonium IUPAC Name: [(1R)-1-(3-fluoro-4-methoxyphenyl)-2-[(2S)-octan-2-yl]oxyethyl]azanium Traditional Name: [(1R)-1-(3-fluoro-4-methoxy-phenyl)-2-[(1S)-1-methylheptoxy]ethyl]ammonium Formula: C17H29FNO2+ MolecularWeight: 298.416063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OCC(C1=CC(=C(C=C1)OC)F)[NH3+]

Isomeric SMILES

CCCCCC[C@H](C)OC[C@@H](C1=CC(=C(C=C1)OC)F)[NH3+]

InChI

InChI=1S/C17H28FNO2/c1-4-5-6-7-8-13(2)21-12-16(19)14-9-10-17(20-3)15(18)11-14/h9-11,13,16H,4-8,12,19H2,1-3H3/p+1/t13-,16-/m0/s1