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

Systemtic Name: 2-[4-[bis(4-fluorophenyl)methoxy]-1-ethyl-piperidin-1-ium-1-yl]ethanoate hydrochloride Openeye Name: 2-[4-[bis(4-fluorophenyl)methoxy]-1-ethyl-piperidin-1-ium-1-yl]acetate hydrochloride CAS Name: 2-[4-[bis(4-fluorophenyl)methoxy]-1-ethyl-1-piperidin-1-iumyl]acetate hydrochloride IUPAC Name: 2-[4-[bis(4-fluorophenyl)methoxy]-1-ethylpiperidin-1-ium-1-yl]acetate hydrochloride Traditional Name: 2-[4-[bis(4-fluorophenyl)methoxy]-1-ethyl-piperidin-1-ium-1-yl]acetate hydrochloride Formula: C22H26ClF2NO3 MolecularWeight: 425.896546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25F2NO3.ClH/c1-2-25(15-21(26)27)13-11-20(12-14-25)28-22(16-3-7-18(23)8-4-16)17-5-9-19(24)10-6-17;/h3-10,20,22H,2,11-15H2,1H3;1H