6,6-dimethyl-3,5-bis(oxidanyl)-4-pentanoyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 6,6-dimethyl-3,5-bis(oxidanyl)-4-pentanoyl-cyclohexa-2,4-dien-1-one Openeye Name: 3,5-dihydroxy-6,6-dimethyl-4-pentanoyl-cyclohexa-2,4-dien-1-one CAS Name: 3,5-dihydroxy-6,6-dimethyl-4-(1-oxopentyl)-1-cyclohexa-2,4-dienone IUPAC Name: 3,5-dihydroxy-6,6-dimethyl-4-pentanoylcyclohexa-2,4-dien-1-one Traditional Name: 3,5-dihydroxy-6,6-dimethyl-4-valeryl-cyclohexa-2,4-dien-1-one Formula: C13H18O4 MolecularWeight: 238.27962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=C(C(C(=O)C=C1O)(C)C)O

Isomeric SMILES

CCCCC(=O)C1=C(C(C(=O)C=C1O)(C)C)O

InChI

InChI=1S/C13H18O4/c1-4-5-6-8(14)11-9(15)7-10(16)13(2,3)12(11)17/h7,15,17H,4-6H2,1-3H3