[(1S)-1-[4-(1,3-benzodioxol-5-yloxy)-3-fluoranyl-phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[4-(1,3-benzodioxol-5-yloxy)-3-fluoranyl-phenyl]ethyl]azanium Openeye Name: [(1S)-1-[4-(1,3-benzodioxol-5-yloxy)-3-fluoro-phenyl]ethyl]ammonium CAS Name: [(1S)-1-[4-(1,3-benzodioxol-5-yloxy)-3-fluorophenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[4-(1,3-benzodioxol-5-yloxy)-3-fluorophenyl]ethyl]azanium Traditional Name: [(1S)-1-[4-(1,3-benzodioxol-5-yloxy)-3-fluoro-phenyl]ethyl]ammonium Formula: C15H15FNO3+ MolecularWeight: 276.282903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC2=CC3=C(C=C2)OCO3)F)[NH3+]

Isomeric SMILES

C[C@@H](C1=CC(=C(C=C1)OC2=CC3=C(C=C2)OCO3)F)[NH3+]

InChI

InChI=1S/C15H14FNO3/c1-9(17)10-2-4-13(12(16)6-10)20-11-3-5-14-15(7-11)19-8-18-14/h2-7,9H,8,17H2,1H3/p+1/t9-/m0/s1