3-(9,9-didecoxynonoxy)-2-oxidanyl-benzoate

Systemtic Name: 3-(9,9-didecoxynonoxy)-2-oxidanyl-benzoate Openeye Name: 3-(9,9-didecoxynonoxy)-2-hydroxy-benzoate CAS Name: 3-(9,9-didecoxynonoxy)-2-hydroxybenzoate IUPAC Name: 3-(9,9-didecoxynonoxy)-2-hydroxybenzoate Traditional Name: 3-(9,9-didecoxynonoxy)-2-hydroxy-benzoate Formula: C36H63O6- MolecularWeight: 591.88182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(CCCCCCCCOC1=CC=CC(=C1O)C(=O)[O-])OCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCOC(CCCCCCCCOC1=CC=CC(=C1O)C(=O)[O-])OCCCCCCCCCC

InChI

InChI=1S/C36H64O6/c1-3-5-7-9-11-14-19-23-30-41-34(42-31-24-20-15-12-10-8-6-4-2)28-21-17-13-16-18-22-29-40-33-27-25-26-32(35(33)37)36(38)39/h25-27,34,37H,3-24,28-31H2,1-2H3,(H,38,39)/p-1