3-oxidanylbutyl octadecanoate

Systemtic Name: 3-oxidanylbutyl octadecanoate Openeye Name: 3-hydroxybutyl octadecanoate CAS Name: octadecanoic acid 3-hydroxybutyl ester IUPAC Name: 3-hydroxybutyl octadecanoate Traditional Name: stearic acid 3-hydroxybutyl ester Formula: C22H44O3 MolecularWeight: 356.58296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCCC(C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCCC(C)O

InChI

InChI=1S/C22H44O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(24)25-20-19-21(2)23/h21,23H,3-20H2,1-2H3