[(1S)-1-[3-fluoranyl-4-(4-methylpentoxy)phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[3-fluoranyl-4-(4-methylpentoxy)phenyl]ethyl]azanium Openeye Name: [(1S)-1-(3-fluoro-4-isohexyloxy-phenyl)ethyl]ammonium CAS Name: [(1S)-1-[3-fluoro-4-(4-methylpentoxy)phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[3-fluoro-4-(4-methylpentoxy)phenyl]ethyl]azanium Traditional Name: [(1S)-1-(3-fluoro-4-isohexyloxy-phenyl)ethyl]ammonium Formula: C14H23FNO+ MolecularWeight: 240.336923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC1=C(C=C(C=C1)C(C)[NH3+])F

Isomeric SMILES

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

InChI

InChI=1S/C14H22FNO/c1-10(2)5-4-8-17-14-7-6-12(11(3)16)9-13(14)15/h6-7,9-11H,4-5,8,16H2,1-3H3/p+1/t11-/m0/s1