3-octadecyl-2,5-bis(oxidanyl)benzoate

Systemtic Name: 3-octadecyl-2,5-bis(oxidanyl)benzoate Openeye Name: 2,5-dihydroxy-3-octadecyl-benzoate CAS Name: 2,5-dihydroxy-3-octadecylbenzoate IUPAC Name: 2,5-dihydroxy-3-octadecylbenzoate Traditional Name: 2,5-dihydroxy-3-stearyl-benzoate Formula: C25H41O4- MolecularWeight: 405.59064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=C(C(=CC(=C1)O)C(=O)[O-])O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=C(C(=CC(=C1)O)C(=O)[O-])O

InChI

InChI=1S/C25H42O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-19-22(26)20-23(24(21)27)25(28)29/h19-20,26-27H,2-18H2,1H3,(H,28,29)/p-1