3-octadecoxy-5-[6-(4-oxidanylphenoxy)hexoxy]benzoic acid

Systemtic Name: 3-octadecoxy-5-[6-(4-oxidanylphenoxy)hexoxy]benzoic acid Openeye Name: 3-[6-(4-hydroxyphenoxy)hexoxy]-5-octadecoxy-benzoic acid CAS Name: 3-[6-(4-hydroxyphenoxy)hexoxy]-5-octadecoxybenzoic acid IUPAC Name: 3-[6-(4-hydroxyphenoxy)hexoxy]-5-octadecoxybenzoic acid Traditional Name: 3-[6-(4-hydroxyphenoxy)hexoxy]-5-stearyloxy-benzoic acid Formula: C37H58O6 MolecularWeight: 598.85282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC(=CC(=C1)C(=O)O)OCCCCCCOC2=CC=C(C=C2)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC(=CC(=C1)C(=O)O)OCCCCCCOC2=CC=C(C=C2)O

InChI

InChI=1S/C37H58O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-27-42-35-29-32(37(39)40)30-36(31-35)43-28-21-18-17-20-26-41-34-24-22-33(38)23-25-34/h22-25,29-31,38H,2-21,26-28H2,1H3,(H,39,40)