2,2-bis(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)decanedioate

Systemtic Name: 2,2-bis(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)decanedioate Openeye Name: 2,2-bis(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)decanedioate CAS Name: 2,2-bis(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)decanedioate IUPAC Name: 2,2-bis(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)decanedioate Traditional Name: 2,2-bis(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)sebacate Formula: C28H52N2O4 MolecularWeight: 480.72348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)C(CCCCCCCC(=O)[O-])(C2CC([NH2+]C(C2)(C)C)(C)C)C(=O)[O-])C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)C(CCCCCCCC(=O)[O-])(C2CC([NH2+]C(C2)(C)C)(C)C)C(=O)[O-])C

InChI

InChI=1S/C28H52N2O4/c1-24(2)16-20(17-25(3,4)29-24)28(23(33)34,15-13-11-9-10-12-14-22(31)32)21-18-26(5,6)30-27(7,8)19-21/h20-21,29-30H,9-19H2,1-8H3,(H,31,32)(H,33,34)