2-hexadecyl-2-oxidanyl-3-oxidanylidene-icosanoate

Systemtic Name: 2-hexadecyl-2-oxidanyl-3-oxidanylidene-icosanoate Openeye Name: 2-hexadecyl-2-hydroxy-3-oxo-icosanoate CAS Name: 2-hexadecyl-2-hydroxy-3-oxoeicosanoate IUPAC Name: 2-hexadecyl-2-hydroxy-3-oxoicosanoate Traditional Name: 2-cetyl-2-hydroxy-3-keto-arachidate Formula: C36H69O4- MolecularWeight: 565.93066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)C(CCCCCCCCCCCCCCCC)(C(=O)[O-])O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)C(CCCCCCCCCCCCCCCC)(C(=O)[O-])O

InChI

InChI=1S/C36H70O4/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34(37)36(40,35(38)39)33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h40H,3-33H2,1-2H3,(H,38,39)/p-1