3-[2-(2,2,6,6-tetramethyl-4-oxidanylidene-piperidin-1-ium-1-yl)ethoxy]benzoate

Systemtic Name: 3-[2-(2,2,6,6-tetramethyl-4-oxidanylidene-piperidin-1-ium-1-yl)ethoxy]benzoate Openeye Name: 3-[2-(2,2,6,6-tetramethyl-4-oxo-piperidin-1-ium-1-yl)ethoxy]benzoate CAS Name: 3-[2-(2,2,6,6-tetramethyl-4-oxo-1-piperidin-1-iumyl)ethoxy]benzoate IUPAC Name: 3-[2-(2,2,6,6-tetramethyl-4-oxopiperidin-1-ium-1-yl)ethoxy]benzoate Traditional Name: 3-[2-(4-keto-2,2,6,6-tetramethyl-piperidin-1-ium-1-yl)ethoxy]benzoate Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)CC([NH+]1CCOC2=CC=CC(=C2)C(=O)[O-])(C)C)C

Isomeric SMILES

CC1(CC(=O)CC([NH+]1CCOC2=CC=CC(=C2)C(=O)[O-])(C)C)C

InChI

InChI=1S/C18H25NO4/c1-17(2)11-14(20)12-18(3,4)19(17)8-9-23-15-7-5-6-13(10-15)16(21)22/h5-7,10H,8-9,11-12H2,1-4H3,(H,21,22)