methyl 16-(3-oxidanyl-5-pentyl-phenoxy)hexadecanoate

Systemtic Name: methyl 16-(3-oxidanyl-5-pentyl-phenoxy)hexadecanoate Openeye Name: methyl 16-(3-hydroxy-5-pentyl-phenoxy)hexadecanoate CAS Name: 16-(3-hydroxy-5-pentylphenoxy)hexadecanoic acid methyl ester IUPAC Name: methyl 16-(3-hydroxy-5-pentylphenoxy)hexadecanoate Traditional Name: 16-(3-amyl-5-hydroxy-phenoxy)palmitic acid methyl ester Formula: C28H48O4 MolecularWeight: 448.67832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=CC(=C1)OCCCCCCCCCCCCCCCC(=O)OC)O

Isomeric SMILES

CCCCCC1=CC(=CC(=C1)OCCCCCCCCCCCCCCCC(=O)OC)O

InChI

InChI=1S/C28H48O4/c1-3-4-16-19-25-22-26(29)24-27(23-25)32-21-18-15-13-11-9-7-5-6-8-10-12-14-17-20-28(30)31-2/h22-24,29H,3-21H2,1-2H3