2-hexadecyl-3,4,5-tris(oxidanyl)benzoic acid

Systemtic Name: 2-hexadecyl-3,4,5-tris(oxidanyl)benzoic acid Openeye Name: 2-hexadecyl-3,4,5-trihydroxy-benzoic acid CAS Name: 2-hexadecyl-3,4,5-trihydroxybenzoic acid IUPAC Name: 2-hexadecyl-3,4,5-trihydroxybenzoic acid Traditional Name: 2-cetyl-3,4,5-trihydroxy-benzoic acid Formula: C23H38O5 MolecularWeight: 394.54482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1=C(C(=C(C=C1C(=O)O)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC1=C(C(=C(C=C1C(=O)O)O)O)O

InChI

InChI=1S/C23H38O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-19(23(27)28)17-20(24)22(26)21(18)25/h17,24-26H,2-16H2,1H3,(H,27,28)