methyl 15-methyl-3-oxidanyl-hexadecanoate

Systemtic Name: methyl 15-methyl-3-oxidanyl-hexadecanoate Openeye Name: methyl 3-hydroxy-15-methyl-hexadecanoate CAS Name: 3-hydroxy-15-methylhexadecanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-15-methylhexadecanoate Traditional Name: 3-hydroxy-15-methyl-palmitic acid methyl ester Formula: C18H36O3 MolecularWeight: 300.47664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCC(CC(=O)OC)O

Isomeric SMILES

CC(C)CCCCCCCCCCCC(CC(=O)OC)O

InChI

InChI=1S/C18H36O3/c1-16(2)13-11-9-7-5-4-6-8-10-12-14-17(19)15-18(20)21-3/h16-17,19H,4-15H2,1-3H3