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

Systemtic Name: 2-[1-[bis(4-fluorophenyl)methoxy]piperidin-1-ium-1-yl]propanoate hydrochloride Openeye Name: 2-[1-[bis(4-fluorophenyl)methoxy]piperidin-1-ium-1-yl]propanoate hydrochloride CAS Name: 2-[1-[bis(4-fluorophenyl)methoxy]-1-piperidin-1-iumyl]propanoate hydrochloride IUPAC Name: 2-[1-[bis(4-fluorophenyl)methoxy]piperidin-1-ium-1-yl]propanoate hydrochloride Traditional Name: 2-[1-[bis(4-fluorophenyl)methoxy]piperidin-1-ium-1-yl]propionate hydrochloride Formula: C21H24ClF2NO3 MolecularWeight: 411.869966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23F2NO3.ClH/c1-15(21(25)26)24(13-3-2-4-14-24)27-20(16-5-9-18(22)10-6-16)17-7-11-19(23)12-8-17;/h5-12,15,20H,2-4,13-14H2,1H3;1H