(3R)-3-(4-fluorophenyl)-3-piperidin-1-ium-4-yl-propanoate

Systemtic Name: (3R)-3-(4-fluorophenyl)-3-piperidin-1-ium-4-yl-propanoate Openeye Name: (3R)-3-(4-fluorophenyl)-3-piperidin-1-ium-4-yl-propanoate CAS Name: (3R)-3-(4-fluorophenyl)-3-(4-piperidin-1-iumyl)propanoate IUPAC Name: (3R)-3-(4-fluorophenyl)-3-piperidin-1-ium-4-ylpropanoate Traditional Name: (3R)-3-(4-fluorophenyl)-3-piperidin-1-ium-4-yl-propionate Formula: C14H18FNO2 MolecularWeight: 251.296623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1C(CC(=O)[O-])C2=CC=C(C=C2)F

Isomeric SMILES

C1C[NH2+]CCC1[C@@H](CC(=O)[O-])C2=CC=C(C=C2)F

InChI

InChI=1S/C14H18FNO2/c15-12-3-1-10(2-4-12)13(9-14(17)18)11-5-7-16-8-6-11/h1-4,11,13,16H,5-9H2,(H,17,18)/t13-/m0/s1