[2-(hydroxymethyl)-1,5-bis(oxidanyl)pentan-2-yl] octadecanoate

Systemtic Name: [2-(hydroxymethyl)-1,5-bis(oxidanyl)pentan-2-yl] octadecanoate Openeye Name: [4-hydroxy-1,1-bis(hydroxymethyl)butyl] octadecanoate CAS Name: octadecanoic acid [1,5-dihydroxy-2-(hydroxymethyl)pentan-2-yl] ester IUPAC Name: [1,5-dihydroxy-2-(hydroxymethyl)pentan-2-yl] octadecanoate Traditional Name: stearic acid (4-hydroxy-1,1-dimethylol-butyl) ester Formula: C24H48O5 MolecularWeight: 416.63492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(CCCO)(CO)CO

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(CCCO)(CO)CO

InChI

InChI=1S/C24H48O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-23(28)29-24(21-26,22-27)19-17-20-25/h25-27H,2-22H2,1H3