2-oxidanylpropane-1,2,3-tricarboxylic acid; (1,2,2,6,6-pentamethylpiperidin-4-yl) N-octadecylcarbamate

Systemtic Name: 2-oxidanylpropane-1,2,3-tricarboxylic acid; (1,2,2,6,6-pentamethylpiperidin-4-yl) N-octadecylcarbamate Openeye Name: citric acid; (1,2,2,6,6-pentamethyl-4-piperidyl) N-octadecylcarbamate CAS Name: 2-hydroxypropane-1,2,3-tricarboxylic acid; N-octadecylcarbamic acid (1,2,2,6,6-pentamethyl-4-piperidinyl) ester IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylic acid; (1,2,2,6,6-pentamethylpiperidin-4-yl) N-octadecylcarbamate Traditional Name: citric acid; N-stearylcarbamic acid (1,2,2,6,6-pentamethyl-4-piperidyl) ester Formula: C35H66N2O9 MolecularWeight: 658.90654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OC1CC(N(C(C1)(C)C)C)(C)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OC1CC(N(C(C1)(C)C)C)(C)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C29H58N2O2.C6H8O7/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-30-27(32)33-26-24-28(2,3)31(6)29(4,5)25-26;7-3(8)1-6(13,5(11)12)2-4(9)10/h26H,7-25H2,1-6H3,(H,30,32);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)