5-octadecoxy-3-(4-oxidanylphenoxy)-2-propoxy-benzoic acid

Systemtic Name: 5-octadecoxy-3-(4-oxidanylphenoxy)-2-propoxy-benzoic acid Openeye Name: 3-(4-hydroxyphenoxy)-5-octadecoxy-2-propoxy-benzoic acid CAS Name: 3-(4-hydroxyphenoxy)-5-octadecoxy-2-propoxybenzoic acid IUPAC Name: 3-(4-hydroxyphenoxy)-5-octadecoxy-2-propoxybenzoic acid Traditional Name: 3-(4-hydroxyphenoxy)-2-propoxy-5-stearyloxy-benzoic acid Formula: C34H52O6 MolecularWeight: 556.77308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC(=C(C(=C1)C(=O)O)OCCC)OC2=CC=C(C=C2)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC(=C(C(=C1)C(=O)O)OCCC)OC2=CC=C(C=C2)O

InChI

InChI=1S/C34H52O6/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25-38-30-26-31(34(36)37)33(39-24-4-2)32(27-30)40-29-22-20-28(35)21-23-29/h20-23,26-27,35H,3-19,24-25H2,1-2H3,(H,36,37)