1-[3-butyl-2,4-bis(oxidanyl)phenyl]ethanone

Systemtic Name: 1-[3-butyl-2,4-bis(oxidanyl)phenyl]ethanone Openeye Name: 1-(3-butyl-2,4-dihydroxy-phenyl)ethanone CAS Name: 1-(3-butyl-2,4-dihydroxyphenyl)ethanone IUPAC Name: 1-(3-butyl-2,4-dihydroxyphenyl)ethanone Traditional Name: 1-(3-butyl-2,4-dihydroxy-phenyl)ethanone Formula: C12H16O3 MolecularWeight: 208.25364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1O)C(=O)C)O

Isomeric SMILES

CCCCC1=C(C=CC(=C1O)C(=O)C)O

InChI

InChI=1S/C12H16O3/c1-3-4-5-10-11(14)7-6-9(8(2)13)12(10)15/h6-7,14-15H,3-5H2,1-2H3