(5-hexyl-2-oxidanyl-phenyl) hexadecanoate

Systemtic Name: (5-hexyl-2-oxidanyl-phenyl) hexadecanoate Openeye Name: (5-hexyl-2-hydroxy-phenyl) hexadecanoate CAS Name: hexadecanoic acid (5-hexyl-2-hydroxyphenyl) ester IUPAC Name: (5-hexyl-2-hydroxyphenyl) hexadecanoate Traditional Name: palmitic acid (5-hexyl-2-hydroxy-phenyl) ester Formula: C28H48O3 MolecularWeight: 432.67892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC1=C(C=CC(=C1)CCCCCC)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC1=C(C=CC(=C1)CCCCCC)O

InChI

InChI=1S/C28H48O3/c1-3-5-7-9-10-11-12-13-14-15-16-17-19-21-28(30)31-27-24-25(22-23-26(27)29)20-18-8-6-4-2/h22-24,29H,3-21H2,1-2H3