11-methyl-12-[2-(4-oxidanyl-4-oxidanylidene-butoxy)phenoxy]dodecanoic acid

Systemtic Name: 11-methyl-12-[2-(4-oxidanyl-4-oxidanylidene-butoxy)phenoxy]dodecanoic acid Openeye Name: 12-[2-(4-hydroxy-4-oxo-butoxy)phenoxy]-11-methyl-dodecanoic acid CAS Name: 12-[2-(4-hydroxy-4-oxobutoxy)phenoxy]-11-methyldodecanoic acid IUPAC Name: 12-[2-(4-hydroxy-4-oxobutoxy)phenoxy]-11-methyldodecanoic acid Traditional Name: 12-[2-(4-hydroxy-4-keto-butoxy)phenoxy]-11-methyl-lauric acid Formula: C23H36O6 MolecularWeight: 408.52834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCCCCCC(=O)O)COC1=CC=CC=C1OCCCC(=O)O

Isomeric SMILES

CC(CCCCCCCCCC(=O)O)COC1=CC=CC=C1OCCCC(=O)O

InChI

InChI=1S/C23H36O6/c1-19(12-7-5-3-2-4-6-8-15-22(24)25)18-29-21-14-10-9-13-20(21)28-17-11-16-23(26)27/h9-10,13-14,19H,2-8,11-12,15-18H2,1H3,(H,24,25)(H,26,27)