[(4S)-1,3,3-trimethyl-4-phenyl-piperidin-1-ium-4-yl] ethanoate

Systemtic Name: [(4S)-1,3,3-trimethyl-4-phenyl-piperidin-1-ium-4-yl] ethanoate Openeye Name: [(4S)-1,3,3-trimethyl-4-phenyl-piperidin-1-ium-4-yl] acetate CAS Name: acetic acid [(4S)-1,3,3-trimethyl-4-phenyl-4-piperidin-1-iumyl] ester IUPAC Name: [(4S)-1,3,3-trimethyl-4-phenylpiperidin-1-ium-4-yl] acetate Traditional Name: acetic acid [(4S)-1,3,3-trimethyl-4-phenyl-piperidin-1-ium-4-yl] ester Formula: C16H24NO2+ MolecularWeight: 262.36726

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(CC[NH+](CC1(C)C)C)C2=CC=CC=C2

Isomeric SMILES

CC(=O)O[C@@]1(CC[NH+](CC1(C)C)C)C2=CC=CC=C2

InChI

InChI=1S/C16H23NO2/c1-13(18)19-16(14-8-6-5-7-9-14)10-11-17(4)12-15(16,2)3/h5-9H,10-12H2,1-4H3/p+1/t16-/m0/s1