4-[2-[4-(5-methyl-5-oxidanyl-hexyl)phenyl]ethyl]benzene-1,2-diol

Systemtic Name: 4-[2-[4-(5-methyl-5-oxidanyl-hexyl)phenyl]ethyl]benzene-1,2-diol Openeye Name: 4-[2-[4-(5-hydroxy-5-methyl-hexyl)phenyl]ethyl]benzene-1,2-diol CAS Name: 4-[2-[4-(5-hydroxy-5-methylhexyl)phenyl]ethyl]benzene-1,2-diol IUPAC Name: 4-[2-[4-(5-hydroxy-5-methylhexyl)phenyl]ethyl]benzene-1,2-diol Traditional Name: 4-[2-[4-(5-hydroxy-5-methyl-hexyl)phenyl]ethyl]pyrocatechol Formula: C21H28O3 MolecularWeight: 328.44522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCC1=CC=C(C=C1)CCC2=CC(=C(C=C2)O)O)O

Isomeric SMILES

CC(C)(CCCCC1=CC=C(C=C1)CCC2=CC(=C(C=C2)O)O)O

InChI

InChI=1S/C21H28O3/c1-21(2,24)14-4-3-5-16-6-8-17(9-7-16)10-11-18-12-13-19(22)20(23)15-18/h6-9,12-13,15,22-24H,3-5,10-11,14H2,1-2H3