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

Systemtic Name: 5-methyl-4-[(2,2,6,6-tetramethyl-4-oxidanylidene-piperidin-1-ium-1-yl)methyl]furan-2-carboxylate Openeye Name: 5-methyl-4-[(2,2,6,6-tetramethyl-4-oxo-piperidin-1-ium-1-yl)methyl]furan-2-carboxylate CAS Name: 5-methyl-4-[(2,2,6,6-tetramethyl-4-oxo-1-piperidin-1-iumyl)methyl]-2-furancarboxylate IUPAC Name: 5-methyl-4-[(2,2,6,6-tetramethyl-4-oxopiperidin-1-ium-1-yl)methyl]furan-2-carboxylate Traditional Name: 4-[(4-keto-2,2,6,6-tetramethyl-piperidin-1-ium-1-yl)methyl]-5-methyl-2-furoate Formula: C16H23NO4 MolecularWeight: 293.35812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)[O-])C[NH+]2C(CC(=O)CC2(C)C)(C)C

Isomeric SMILES

CC1=C(C=C(O1)C(=O)[O-])C[NH+]2C(CC(=O)CC2(C)C)(C)C

InChI

InChI=1S/C16H23NO4/c1-10-11(6-13(21-10)14(19)20)9-17-15(2,3)7-12(18)8-16(17,4)5/h6H,7-9H2,1-5H3,(H,19,20)