(1,1-dimethylpiperidin-1-ium-4-yl) 2-[3,3-bis(fluoranyl)cyclopentyl]-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: (1,1-dimethylpiperidin-1-ium-4-yl) 2-[3,3-bis(fluoranyl)cyclopentyl]-2-oxidanyl-2-phenyl-ethanoate Openeye Name: (1,1-dimethylpiperidin-1-ium-4-yl) 2-(3,3-difluorocyclopentyl)-2-hydroxy-2-phenyl-acetate CAS Name: 2-(3,3-difluorocyclopentyl)-2-hydroxy-2-phenylacetic acid (1,1-dimethyl-4-piperidin-1-iumyl) ester IUPAC Name: (1,1-dimethylpiperidin-1-ium-4-yl) 2-(3,3-difluorocyclopentyl)-2-hydroxy-2-phenylacetate Traditional Name: 2-(3,3-difluorocyclopentyl)-2-hydroxy-2-phenyl-acetic acid (1,1-dimethylpiperidin-1-ium-4-yl) ester Formula: C20H28F2NO3+ MolecularWeight: 368.438026

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(CC1)OC(=O)C(C2CCC(C2)(F)F)(C3=CC=CC=C3)O)C

Isomeric SMILES

C[N+]1(CCC(CC1)OC(=O)C(C2CCC(C2)(F)F)(C3=CC=CC=C3)O)C

InChI

InChI=1S/C20H28F2NO3/c1-23(2)12-9-17(10-13-23)26-18(24)20(25,15-6-4-3-5-7-15)16-8-11-19(21,22)14-16/h3-7,16-17,25H,8-14H2,1-2H3/q+1