1-piperidin-1-ium-1-ylpropan-2-yl 2-(4-fluoranylphenoxy)ethanoate

Systemtic Name: 1-piperidin-1-ium-1-ylpropan-2-yl 2-(4-fluoranylphenoxy)ethanoate Openeye Name: (1-methyl-2-piperidin-1-ium-1-yl-ethyl) 2-(4-fluorophenoxy)acetate CAS Name: 2-(4-fluorophenoxy)acetic acid 1-(1-piperidin-1-iumyl)propan-2-yl ester IUPAC Name: 1-piperidin-1-ium-1-ylpropan-2-yl 2-(4-fluorophenoxy)acetate Traditional Name: 2-(4-fluorophenoxy)acetic acid (1-methyl-2-piperidin-1-ium-1-yl-ethyl) ester Formula: C16H23FNO3+ MolecularWeight: 296.357123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+]1CCCCC1)OC(=O)COC2=CC=C(C=C2)F

Isomeric SMILES

CC(C[NH+]1CCCCC1)OC(=O)COC2=CC=C(C=C2)F

InChI

InChI=1S/C16H22FNO3/c1-13(11-18-9-3-2-4-10-18)21-16(19)12-20-15-7-5-14(17)6-8-15/h5-8,13H,2-4,9-12H2,1H3/p+1