2,2-bis(hydroxymethyl)propane-1,3-diol; octadecyl 2,3-bis(oxidanyl)propanoate

Systemtic Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; octadecyl 2,3-bis(oxidanyl)propanoate Openeye Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; octadecyl 2,3-dihydroxypropanoate CAS Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; 2,3-dihydroxypropanoic acid octadecyl ester IUPAC Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; octadecyl 2,3-dihydroxypropanoate Traditional Name: 2,3-dihydroxypropionic acid stearyl ester; 2,2-dimethylolpropane-1,3-diol Formula: C26H54O8 MolecularWeight: 494.70216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C(CO)O.C(C(CO)(CO)CO)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C(CO)O.C(C(CO)(CO)CO)O

InChI

InChI=1S/C21H42O4.C5H12O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25-21(24)20(23)19-22;6-1-5(2-7,3-8)4-9/h20,22-23H,2-19H2,1H3;6-9H,1-4H2