5-octadecoxy-2-[6-(4-oxidanylphenoxy)hexoxy]benzoic acid

Systemtic Name: 5-octadecoxy-2-[6-(4-oxidanylphenoxy)hexoxy]benzoic acid Openeye Name: 2-[6-(4-hydroxyphenoxy)hexoxy]-5-octadecoxy-benzoic acid CAS Name: 2-[6-(4-hydroxyphenoxy)hexoxy]-5-octadecoxybenzoic acid IUPAC Name: 2-[6-(4-hydroxyphenoxy)hexoxy]-5-octadecoxybenzoic acid Traditional Name: 2-[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(=C(C=C1)OCCCCCCOC2=CC=C(C=C2)O)C(=O)O

Isomeric SMILES

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

InChI

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