methyl 3-oxidanyl-2-tetradecanoyl-octadecanoate

Systemtic Name: methyl 3-oxidanyl-2-tetradecanoyl-octadecanoate Openeye Name: methyl 3-hydroxy-2-tetradecanoyl-octadecanoate CAS Name: 3-hydroxy-2-(1-oxotetradecyl)octadecanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-tetradecanoyloctadecanoate Traditional Name: 3-hydroxy-2-tetradecanoyl-stearic acid methyl ester Formula: C33H64O4 MolecularWeight: 524.85886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(C(C(=O)CCCCCCCCCCCCC)C(=O)OC)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(C(C(=O)CCCCCCCCCCCCC)C(=O)OC)O

InChI

InChI=1S/C33H64O4/c1-4-6-8-10-12-14-16-17-19-21-23-25-27-29-31(35)32(33(36)37-3)30(34)28-26-24-22-20-18-15-13-11-9-7-5-2/h31-32,35H,4-29H2,1-3H3