1,3-bis(oxidanyl)propan-2-yl 20-methylhenicosanoate

Systemtic Name: 1,3-bis(oxidanyl)propan-2-yl 20-methylhenicosanoate Openeye Name: [2-hydroxy-1-(hydroxymethyl)ethyl] 20-methylhenicosanoate CAS Name: 20-methylheneicosanoic acid 1,3-dihydroxypropan-2-yl ester IUPAC Name: 1,3-dihydroxypropan-2-yl 20-methylhenicosanoate Traditional Name: 20-methylheneicosanoic acid (2-hydroxy-1-methylol-ethyl) ester Formula: C25H50O4 MolecularWeight: 414.6621

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCCCCCCC(=O)OC(CO)CO

Isomeric SMILES

CC(C)CCCCCCCCCCCCCCCCCCC(=O)OC(CO)CO

InChI

InChI=1S/C25H50O4/c1-23(2)19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-25(28)29-24(21-26)22-27/h23-24,26-27H,3-22H2,1-2H3