(2S)-2-phenyl-2-(2,2,6,6-tetramethyl-4-oxidanylidene-piperidin-1-ium-1-yl)ethanoate

Systemtic Name: (2S)-2-phenyl-2-(2,2,6,6-tetramethyl-4-oxidanylidene-piperidin-1-ium-1-yl)ethanoate Openeye Name: (2S)-2-phenyl-2-(2,2,6,6-tetramethyl-4-oxo-piperidin-1-ium-1-yl)acetate CAS Name: (2S)-2-phenyl-2-(2,2,6,6-tetramethyl-4-oxo-1-piperidin-1-iumyl)acetate IUPAC Name: (2S)-2-phenyl-2-(2,2,6,6-tetramethyl-4-oxopiperidin-1-ium-1-yl)acetate Traditional Name: (2S)-2-(4-keto-2,2,6,6-tetramethyl-piperidin-1-ium-1-yl)-2-phenyl-acetate Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23NO3/c1-16(2)10-13(19)11-17(3,4)18(16)14(15(20)21)12-8-6-5-7-9-12/h5-9,14H,10-11H2,1-4H3,(H,20,21)/t14-/m0/s1