1-[2,3-bis(oxidanyl)phenyl]hexadecan-1-one

Systemtic Name: 1-[2,3-bis(oxidanyl)phenyl]hexadecan-1-one Openeye Name: 1-(2,3-dihydroxyphenyl)hexadecan-1-one CAS Name: 1-(2,3-dihydroxyphenyl)-1-hexadecanone IUPAC Name: 1-(2,3-dihydroxyphenyl)hexadecan-1-one Traditional Name: 1-(2,3-dihydroxyphenyl)hexadecan-1-one Formula: C22H36O3 MolecularWeight: 348.51944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C1=C(C(=CC=C1)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C1=C(C(=CC=C1)O)O

InChI

InChI=1S/C22H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20(23)19-16-15-18-21(24)22(19)25/h15-16,18,24-25H,2-14,17H2,1H3