[3-[[3-(5-methyl-5-oxidanyl-hexyl)phenoxy]methyl]phenyl]methanediol

Systemtic Name: [3-[[3-(5-methyl-5-oxidanyl-hexyl)phenoxy]methyl]phenyl]methanediol Openeye Name: [3-[[3-(5-hydroxy-5-methyl-hexyl)phenoxy]methyl]phenyl]methanediol CAS Name: [3-[[3-(5-hydroxy-5-methylhexyl)phenoxy]methyl]phenyl]methanediol IUPAC Name: [3-[[3-(5-hydroxy-5-methylhexyl)phenoxy]methyl]phenyl]methanediol Traditional Name: [3-[[3-(5-hydroxy-5-methyl-hexyl)phenoxy]methyl]phenyl]methanediol Formula: C21H28O4 MolecularWeight: 344.44462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCC1=CC(=CC=C1)OCC2=CC(=CC=C2)C(O)O)O

Isomeric SMILES

CC(C)(CCCCC1=CC(=CC=C1)OCC2=CC(=CC=C2)C(O)O)O

InChI

InChI=1S/C21H28O4/c1-21(2,24)12-4-3-7-16-8-6-11-19(14-16)25-15-17-9-5-10-18(13-17)20(22)23/h5-6,8-11,13-14,20,22-24H,3-4,7,12,15H2,1-2H3