2-[4-[(2,2,6,6-tetramethyl-4-oxidanylidene-piperidin-1-ium-1-yl)methyl]phenyl]ethanoate

Systemtic Name: 2-[4-[(2,2,6,6-tetramethyl-4-oxidanylidene-piperidin-1-ium-1-yl)methyl]phenyl]ethanoate Openeye Name: 2-[4-[(2,2,6,6-tetramethyl-4-oxo-piperidin-1-ium-1-yl)methyl]phenyl]acetate CAS Name: 2-[4-[(2,2,6,6-tetramethyl-4-oxo-1-piperidin-1-iumyl)methyl]phenyl]acetate IUPAC Name: 2-[4-[(2,2,6,6-tetramethyl-4-oxopiperidin-1-ium-1-yl)methyl]phenyl]acetate Traditional Name: 2-[4-[(4-keto-2,2,6,6-tetramethyl-piperidin-1-ium-1-yl)methyl]phenyl]acetate Formula: C18H25NO3 MolecularWeight: 303.396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)CC([NH+]1CC2=CC=C(C=C2)CC(=O)[O-])(C)C)C

Isomeric SMILES

CC1(CC(=O)CC([NH+]1CC2=CC=C(C=C2)CC(=O)[O-])(C)C)C

InChI

InChI=1S/C18H25NO3/c1-17(2)10-15(20)11-18(3,4)19(17)12-14-7-5-13(6-8-14)9-16(21)22/h5-8H,9-12H2,1-4H3,(H,21,22)