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

Systemtic Name: 2-[1-[bis(4-fluorophenyl)methoxy]piperidin-1-ium-1-yl]hexanoate hydrochloride Openeye Name: 2-[1-[bis(4-fluorophenyl)methoxy]piperidin-1-ium-1-yl]hexanoate hydrochloride CAS Name: 2-[1-[bis(4-fluorophenyl)methoxy]-1-piperidin-1-iumyl]hexanoate hydrochloride IUPAC Name: 2-[1-[bis(4-fluorophenyl)methoxy]piperidin-1-ium-1-yl]hexanoate hydrochloride Traditional Name: 2-[1-[bis(4-fluorophenyl)methoxy]piperidin-1-ium-1-yl]hexanoate hydrochloride Formula: C24H30ClF2NO3 MolecularWeight: 453.949706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29F2NO3.ClH/c1-2-3-7-22(24(28)29)27(16-5-4-6-17-27)30-23(18-8-12-20(25)13-9-18)19-10-14-21(26)15-11-19;/h8-15,22-23H,2-7,16-17H2,1H3;1H