[(3R)-1-methylpiperidin-1-ium-3-yl] 2-phenoxyethanoate

Systemtic Name: [(3R)-1-methylpiperidin-1-ium-3-yl] 2-phenoxyethanoate Openeye Name: [(3R)-1-methylpiperidin-1-ium-3-yl] 2-phenoxyacetate CAS Name: 2-phenoxyacetic acid [(3R)-1-methyl-3-piperidin-1-iumyl] ester IUPAC Name: [(3R)-1-methylpiperidin-1-ium-3-yl] 2-phenoxyacetate Traditional Name: 2-phenoxyacetic acid [(3R)-1-methylpiperidin-1-ium-3-yl] ester Formula: C14H20NO3+ MolecularWeight: 250.3135

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC(C1)OC(=O)COC2=CC=CC=C2

Isomeric SMILES

C[NH+]1CCC[C@H](C1)OC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C14H19NO3/c1-15-9-5-8-13(10-15)18-14(16)11-17-12-6-3-2-4-7-12/h2-4,6-7,13H,5,8-11H2,1H3/p+1/t13-/m1/s1