1-[2,4-bis(oxidanyl)-5-pentyl-phenyl]-2-(3,5-dimethylphenoxy)ethanone

Systemtic Name: 1-[2,4-bis(oxidanyl)-5-pentyl-phenyl]-2-(3,5-dimethylphenoxy)ethanone Openeye Name: 1-(2,4-dihydroxy-5-pentyl-phenyl)-2-(3,5-dimethylphenoxy)ethanone CAS Name: 1-(2,4-dihydroxy-5-pentylphenyl)-2-(3,5-dimethylphenoxy)ethanone IUPAC Name: 1-(2,4-dihydroxy-5-pentylphenyl)-2-(3,5-dimethylphenoxy)ethanone Traditional Name: 1-(5-amyl-2,4-dihydroxy-phenyl)-2-(3,5-dimethylphenoxy)ethanone Formula: C21H26O4 MolecularWeight: 342.42874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=C(C(=C1)C(=O)COC2=CC(=CC(=C2)C)C)O)O

Isomeric SMILES

CCCCCC1=C(C=C(C(=C1)C(=O)COC2=CC(=CC(=C2)C)C)O)O

InChI

InChI=1S/C21H26O4/c1-4-5-6-7-16-11-18(20(23)12-19(16)22)21(24)13-25-17-9-14(2)8-15(3)10-17/h8-12,22-23H,4-7,13H2,1-3H3