4-(3-methylbutanoyl)-6,6-bis(3-methylbut-2-enyl)-3,5-bis(oxidanyl)cyclohexa-2,4-dien-1-one

Systemtic Name: 4-(3-methylbutanoyl)-6,6-bis(3-methylbut-2-enyl)-3,5-bis(oxidanyl)cyclohexa-2,4-dien-1-one Openeye Name: 3,5-dihydroxy-4-(3-methylbutanoyl)-6,6-bis(3-methylbut-2-enyl)cyclohexa-2,4-dien-1-one CAS Name: 3,5-dihydroxy-6,6-bis(3-methylbut-2-enyl)-4-(3-methyl-1-oxobutyl)-1-cyclohexa-2,4-dienone IUPAC Name: 3,5-dihydroxy-4-(3-methylbutanoyl)-6,6-bis(3-methylbut-2-enyl)cyclohexa-2,4-dien-1-one Traditional Name: 3,5-dihydroxy-4-isovaleryl-6,6-bis(3-methylbut-2-enyl)cyclohexa-2,4-dien-1-one Formula: C21H30O4 MolecularWeight: 346.4605

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C1=C(C(C(=O)C=C1O)(CC=C(C)C)CC=C(C)C)O

Isomeric SMILES

CC(C)CC(=O)C1=C(C(C(=O)C=C1O)(CC=C(C)C)CC=C(C)C)O

InChI

InChI=1S/C21H30O4/c1-13(2)7-9-21(10-8-14(3)4)18(24)12-17(23)19(20(21)25)16(22)11-15(5)6/h7-8,12,15,23,25H,9-11H2,1-6H3