[(3R)-1-methylpiperidin-1-ium-3-yl] 3-phenylpropanoate

Systemtic Name: [(3R)-1-methylpiperidin-1-ium-3-yl] 3-phenylpropanoate Openeye Name: [(3R)-1-methylpiperidin-1-ium-3-yl] 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [(3R)-1-methyl-3-piperidin-1-iumyl] ester IUPAC Name: [(3R)-1-methylpiperidin-1-ium-3-yl] 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [(3R)-1-methylpiperidin-1-ium-3-yl] ester Formula: C15H22NO2+ MolecularWeight: 248.34068

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC(C1)OC(=O)CCC2=CC=CC=C2

Isomeric SMILES

C[NH+]1CCC[C@H](C1)OC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C15H21NO2/c1-16-11-5-8-14(12-16)18-15(17)10-9-13-6-3-2-4-7-13/h2-4,6-7,14H,5,8-12H2,1H3/p+1/t14-/m1/s1