[1-methyl-1-[3-[3-(trifluoromethyl)phenoxy]propyl]pyrrolidin-1-ium-3-yl] 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: [1-methyl-1-[3-[3-(trifluoromethyl)phenoxy]propyl]pyrrolidin-1-ium-3-yl] 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate Openeye Name: [1-methyl-1-[3-[3-(trifluoromethyl)phenoxy]propyl]pyrrolidin-1-ium-3-yl] 2-cyclopentyl-2-hydroxy-2-phenyl-acetate CAS Name: 2-cyclopentyl-2-hydroxy-2-phenylacetic acid [1-methyl-1-[3-[3-(trifluoromethyl)phenoxy]propyl]-3-pyrrolidin-1-iumyl] ester IUPAC Name: [1-methyl-1-[3-[3-(trifluoromethyl)phenoxy]propyl]pyrrolidin-1-ium-3-yl] 2-cyclopentyl-2-hydroxy-2-phenylacetate Traditional Name: 2-cyclopentyl-2-hydroxy-2-phenyl-acetic acid [1-methyl-1-[3-[3-(trifluoromethyl)phenoxy]propyl]pyrrolidin-1-ium-3-yl] ester Formula: C28H35F3NO4+ MolecularWeight: 506.57701

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(C1)OC(=O)C(C2CCCC2)(C3=CC=CC=C3)O)CCCOC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C[N+]1(CCC(C1)OC(=O)C(C2CCCC2)(C3=CC=CC=C3)O)CCCOC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C28H35F3NO4/c1-32(16-8-18-35-24-14-7-13-23(19-24)28(29,30)31)17-15-25(20-32)36-26(33)27(34,22-11-5-6-12-22)21-9-3-2-4-10-21/h2-4,7,9-10,13-14,19,22,25,34H,5-6,8,11-12,15-18,20H2,1H3/q+1