1-[5-[2-(dioxidanyl)-3-methyl-but-3-enyl]-2,4-bis(oxidanyl)phenyl]ethanone

Systemtic Name: 1-[5-[2-(dioxidanyl)-3-methyl-but-3-enyl]-2,4-bis(oxidanyl)phenyl]ethanone Openeye Name: 1-[5-(2-hydroperoxy-3-methyl-but-3-enyl)-2,4-dihydroxy-phenyl]ethanone CAS Name: 1-[5-(2-hydroperoxy-3-methylbut-3-enyl)-2,4-dihydroxyphenyl]ethanone IUPAC Name: 1-[5-(2-hydroperoxy-3-methylbut-3-enyl)-2,4-dihydroxyphenyl]ethanone Traditional Name: 1-[5-(2-hydroperoxy-3-methyl-but-3-enyl)-2,4-dihydroxy-phenyl]ethanone Formula: C13H16O5 MolecularWeight: 252.26314

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(CC1=C(C=C(C(=C1)C(=O)C)O)O)OO

Isomeric SMILES

CC(=C)C(CC1=C(C=C(C(=C1)C(=O)C)O)O)OO

InChI

InChI=1S/C13H16O5/c1-7(2)13(18-17)5-9-4-10(8(3)14)12(16)6-11(9)15/h4,6,13,15-17H,1,5H2,2-3H3