methyl 16-(4-hexyl-3-oxidanyl-phenoxy)hexadecanoate

Systemtic Name: methyl 16-(4-hexyl-3-oxidanyl-phenoxy)hexadecanoate Openeye Name: methyl 16-(4-hexyl-3-hydroxy-phenoxy)hexadecanoate CAS Name: 16-(4-hexyl-3-hydroxyphenoxy)hexadecanoic acid methyl ester IUPAC Name: methyl 16-(4-hexyl-3-hydroxyphenoxy)hexadecanoate Traditional Name: 16-(4-hexyl-3-hydroxy-phenoxy)palmitic acid methyl ester Formula: C29H50O4 MolecularWeight: 462.7049

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C(C=C1)OCCCCCCCCCCCCCCCC(=O)OC)O

Isomeric SMILES

CCCCCCC1=C(C=C(C=C1)OCCCCCCCCCCCCCCCC(=O)OC)O

InChI

InChI=1S/C29H50O4/c1-3-4-5-17-20-26-22-23-27(25-28(26)30)33-24-19-16-14-12-10-8-6-7-9-11-13-15-18-21-29(31)32-2/h22-23,25,30H,3-21,24H2,1-2H3