3,4,5-tris(11-oxidanylundecoxy)benzoic acid

Systemtic Name: 3,4,5-tris(11-oxidanylundecoxy)benzoic acid Openeye Name: 3,4,5-tris(11-hydroxyundecoxy)benzoic acid CAS Name: 3,4,5-tris(11-hydroxyundecoxy)benzoic acid IUPAC Name: 3,4,5-tris(11-hydroxyundecoxy)benzoic acid Traditional Name: 3,4,5-tris(11-hydroxyundecoxy)benzoic acid Formula: C40H72O8 MolecularWeight: 680.99488

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1OCCCCCCCCCCCO)OCCCCCCCCCCCO)OCCCCCCCCCCCO)C(=O)O

Isomeric SMILES

C1=C(C=C(C(=C1OCCCCCCCCCCCO)OCCCCCCCCCCCO)OCCCCCCCCCCCO)C(=O)O

InChI

InChI=1S/C40H72O8/c41-28-22-16-10-4-1-7-13-19-25-31-46-37-34-36(40(44)45)35-38(47-32-26-20-14-8-2-5-11-17-23-29-42)39(37)48-33-27-21-15-9-3-6-12-18-24-30-43/h34-35,41-43H,1-33H2,(H,44,45)