5-[(2,2,6,6-tetramethyl-4-oxidanylidene-piperidin-1-ium-1-yl)methyl]furan-2-carboxylate

Systemtic Name: 5-[(2,2,6,6-tetramethyl-4-oxidanylidene-piperidin-1-ium-1-yl)methyl]furan-2-carboxylate Openeye Name: 5-[(2,2,6,6-tetramethyl-4-oxo-piperidin-1-ium-1-yl)methyl]furan-2-carboxylate CAS Name: 5-[(2,2,6,6-tetramethyl-4-oxo-1-piperidin-1-iumyl)methyl]-2-furancarboxylate IUPAC Name: 5-[(2,2,6,6-tetramethyl-4-oxopiperidin-1-ium-1-yl)methyl]furan-2-carboxylate Traditional Name: 5-[(4-keto-2,2,6,6-tetramethyl-piperidin-1-ium-1-yl)methyl]-2-furoate Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)CC([NH+]1CC2=CC=C(O2)C(=O)[O-])(C)C)C

Isomeric SMILES

CC1(CC(=O)CC([NH+]1CC2=CC=C(O2)C(=O)[O-])(C)C)C

InChI

InChI=1S/C15H21NO4/c1-14(2)7-10(17)8-15(3,4)16(14)9-11-5-6-12(20-11)13(18)19/h5-6H,7-9H2,1-4H3,(H,18,19)