5-[[3-(6-methyl-6-oxidanyl-heptyl)phenoxy]methyl]benzene-1,3-diol

Systemtic Name: 5-[[3-(6-methyl-6-oxidanyl-heptyl)phenoxy]methyl]benzene-1,3-diol Openeye Name: 5-[[3-(6-hydroxy-6-methyl-heptyl)phenoxy]methyl]benzene-1,3-diol CAS Name: 5-[[3-(6-hydroxy-6-methylheptyl)phenoxy]methyl]benzene-1,3-diol IUPAC Name: 5-[[3-(6-hydroxy-6-methylheptyl)phenoxy]methyl]benzene-1,3-diol Traditional Name: 5-[[3-(6-hydroxy-6-methyl-heptyl)phenoxy]methyl]resorcinol Formula: C21H28O4 MolecularWeight: 344.44462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCCC1=CC(=CC=C1)OCC2=CC(=CC(=C2)O)O)O

Isomeric SMILES

CC(C)(CCCCCC1=CC(=CC=C1)OCC2=CC(=CC(=C2)O)O)O

InChI

InChI=1S/C21H28O4/c1-21(2,24)10-5-3-4-7-16-8-6-9-20(13-16)25-15-17-11-18(22)14-19(23)12-17/h6,8-9,11-14,22-24H,3-5,7,10,15H2,1-2H3