2-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxycarbonylbenzoate

Systemtic Name: 2-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxycarbonylbenzoate Openeye Name: 2-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxycarbonylbenzoate CAS Name: 2-[oxo-[(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)oxy]methyl]benzoate IUPAC Name: 2-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxycarbonylbenzoate Traditional Name: 2-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxycarbonylbenzoate Formula: C17H23NO4 MolecularWeight: 305.36882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)OC(=O)C2=CC=CC=C2C(=O)[O-])C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)OC(=O)C2=CC=CC=C2C(=O)[O-])C

InChI

InChI=1S/C17H23NO4/c1-16(2)9-11(10-17(3,4)18-16)22-15(21)13-8-6-5-7-12(13)14(19)20/h5-8,11,18H,9-10H2,1-4H3,(H,19,20)