2-octoxy-5-[2,2,2-tris(fluoranyl)-1-phenyl-ethyl]pyrrolidin-1-ium 1-oxide

Systemtic Name: 2-octoxy-5-[2,2,2-tris(fluoranyl)-1-phenyl-ethyl]pyrrolidin-1-ium 1-oxide Openeye Name: 2-octoxy-5-(2,2,2-trifluoro-1-phenyl-ethyl)pyrrolidin-1-ium 1-oxide CAS Name: 2-octoxy-5-(2,2,2-trifluoro-1-phenylethyl)pyrrolidin-1-ium 1-oxide IUPAC Name: 2-octoxy-5-(2,2,2-trifluoro-1-phenylethyl)pyrrolidin-1-ium 1-oxide Traditional Name: 2-octoxy-5-(2,2,2-trifluoro-1-phenyl-ethyl)pyrrolidin-1-ium 1-oxide Formula: C20H29F3NO2+ MolecularWeight: 372.44497

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1CCC([N+]1=O)C(C2=CC=CC=C2)C(F)(F)F

Isomeric SMILES

CCCCCCCCOC1CCC([N+]1=O)C(C2=CC=CC=C2)C(F)(F)F

InChI

InChI=1S/C20H29F3NO2/c1-2-3-4-5-6-10-15-26-18-14-13-17(24(18)25)19(20(21,22)23)16-11-8-7-9-12-16/h7-9,11-12,17-19H,2-6,10,13-15H2,1H3/q+1