(E)-6-[4-methyl-2,5-bis(oxidanyl)phenyl]-5-oxidanyl-hept-3-en-2-one

Systemtic Name: (E)-6-[4-methyl-2,5-bis(oxidanyl)phenyl]-5-oxidanyl-hept-3-en-2-one Openeye Name: (E)-6-(2,5-dihydroxy-4-methyl-phenyl)-5-hydroxy-hept-3-en-2-one CAS Name: (E)-6-(2,5-dihydroxy-4-methylphenyl)-5-hydroxy-3-hepten-2-one IUPAC Name: (E)-6-(2,5-dihydroxy-4-methylphenyl)-5-hydroxyhept-3-en-2-one Traditional Name: (E)-6-(2,5-dihydroxy-4-methyl-phenyl)-5-hydroxy-hept-3-en-2-one Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1O)C(C)C(C=CC(=O)C)O)O

Isomeric SMILES

CC1=CC(=C(C=C1O)C(C)C(/C=C/C(=O)C)O)O

InChI

InChI=1S/C14H18O4/c1-8-6-14(18)11(7-13(8)17)10(3)12(16)5-4-9(2)15/h4-7,10,12,16-18H,1-3H3/b5-4+