[(1S)-1-[2-(1,3-benzodioxol-5-ylmethoxy)-5-fluoranyl-phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[2-(1,3-benzodioxol-5-ylmethoxy)-5-fluoranyl-phenyl]ethyl]azanium Openeye Name: [(1S)-1-[2-(1,3-benzodioxol-5-ylmethoxy)-5-fluoro-phenyl]ethyl]ammonium CAS Name: [(1S)-1-[2-(1,3-benzodioxol-5-ylmethoxy)-5-fluorophenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[2-(1,3-benzodioxol-5-ylmethoxy)-5-fluorophenyl]ethyl]azanium Traditional Name: [(1S)-1-(5-fluoro-2-piperonyloxy-phenyl)ethyl]ammonium Formula: C16H17FNO3+ MolecularWeight: 290.309483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)F)OCC2=CC3=C(C=C2)OCO3)[NH3+]

Isomeric SMILES

C[C@@H](C1=C(C=CC(=C1)F)OCC2=CC3=C(C=C2)OCO3)[NH3+]

InChI

InChI=1S/C16H16FNO3/c1-10(18)13-7-12(17)3-5-14(13)19-8-11-2-4-15-16(6-11)21-9-20-15/h2-7,10H,8-9,18H2,1H3/p+1/t10-/m0/s1