5-methyl-2-[[2-methyl-3-(3-methylbut-2-en-2-yl)-4-methylsulfonyl-phenyl]-oxidanyl-methylidene]cyclohexane-1,3-dione

Systemtic Name: 5-methyl-2-[[2-methyl-3-(3-methylbut-2-en-2-yl)-4-methylsulfonyl-phenyl]-oxidanyl-methylidene]cyclohexane-1,3-dione Openeye Name: 2-[[3-(1,2-dimethylprop-1-enyl)-2-methyl-4-methylsulfonyl-phenyl]-hydroxy-methylene]-5-methyl-cyclohexane-1,3-dione CAS Name: 2-[hydroxy-[2-methyl-3-(3-methylbut-2-en-2-yl)-4-methylsulfonylphenyl]methylidene]-5-methylcyclohexane-1,3-dione IUPAC Name: 2-[hydroxy-[2-methyl-3-(3-methylbut-2-en-2-yl)-4-methylsulfonylphenyl]methylidene]-5-methylcyclohexane-1,3-dione Traditional Name: 2-[[3-(1,2-dimethylprop-1-enyl)-4-mesyl-2-methyl-phenyl]-hydroxy-methylene]-5-methyl-cyclohexane-1,3-quinone Formula: C21H26O5S MolecularWeight: 390.49314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C(=C(C2=C(C(=C(C=C2)S(=O)(=O)C)C(=C(C)C)C)C)O)C(=O)C1

Isomeric SMILES

CC1CC(=O)C(=C(C2=C(C(=C(C=C2)S(=O)(=O)C)C(=C(C)C)C)C)O)C(=O)C1

InChI

InChI=1S/C21H26O5S/c1-11(2)13(4)19-14(5)15(7-8-18(19)27(6,25)26)21(24)20-16(22)9-12(3)10-17(20)23/h7-8,12,24H,9-10H2,1-6H3