2-(1,2,2,6,6-pentamethylpiperidin-1-ium-1-yl)docosanoate

Systemtic Name: 2-(1,2,2,6,6-pentamethylpiperidin-1-ium-1-yl)docosanoate Openeye Name: 2-(1,2,2,6,6-pentamethylpiperidin-1-ium-1-yl)docosanoate CAS Name: 2-(1,2,2,6,6-pentamethyl-1-piperidin-1-iumyl)docosanoate IUPAC Name: 2-(1,2,2,6,6-pentamethylpiperidin-1-ium-1-yl)docosanoate Traditional Name: 2-(1,2,2,6,6-pentamethylpiperidin-1-ium-1-yl)behenate Formula: C32H63NO2 MolecularWeight: 493.84812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCC(C(=O)[O-])[N+]1(C(CCCC1(C)C)(C)C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCC(C(=O)[O-])[N+]1(C(CCCC1(C)C)(C)C)C

InChI

InChI=1S/C32H63NO2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26-29(30(34)35)33(6)31(2,3)27-25-28-32(33,4)5/h29H,7-28H2,1-6H3