2-[1-[bis(4-fluorophenyl)methoxy]piperidin-1-ium-1-yl]pentanoate

Systemtic Name: 2-[1-[bis(4-fluorophenyl)methoxy]piperidin-1-ium-1-yl]pentanoate Openeye Name: 2-[1-[bis(4-fluorophenyl)methoxy]piperidin-1-ium-1-yl]pentanoate CAS Name: 2-[1-[bis(4-fluorophenyl)methoxy]-1-piperidin-1-iumyl]pentanoate IUPAC Name: 2-[1-[bis(4-fluorophenyl)methoxy]piperidin-1-ium-1-yl]pentanoate Traditional Name: 2-[1-[bis(4-fluorophenyl)methoxy]piperidin-1-ium-1-yl]valerate Formula: C23H27F2NO3 MolecularWeight: 403.462186

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)[O-])[N+]1(CCCCC1)OC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

Isomeric SMILES

CCCC(C(=O)[O-])[N+]1(CCCCC1)OC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H27F2NO3/c1-2-6-21(23(27)28)26(15-4-3-5-16-26)29-22(17-7-11-19(24)12-8-17)18-9-13-20(25)14-10-18/h7-14,21-22H,2-6,15-16H2,1H3