5-bromanyl-3-(3-methoxy-2-methyl-4-methylsulfonyl-phenyl)carbonyl-5-methyl-bicyclo[4.1.0]heptane-2,4-dione

Systemtic Name: 5-bromanyl-3-(3-methoxy-2-methyl-4-methylsulfonyl-phenyl)carbonyl-5-methyl-bicyclo[4.1.0]heptane-2,4-dione Openeye Name: 5-bromo-3-(3-methoxy-2-methyl-4-methylsulfonyl-benzoyl)-5-methyl-norcarane-2,4-dione CAS Name: 5-bromo-3-[(3-methoxy-2-methyl-4-methylsulfonylphenyl)-oxomethyl]-5-methylbicyclo[4.1.0]heptane-2,4-dione IUPAC Name: 5-bromo-3-(3-methoxy-2-methyl-4-methylsulfonylbenzoyl)-5-methylbicyclo[4.1.0]heptane-2,4-dione Traditional Name: 5-bromo-3-(4-mesyl-3-methoxy-2-methyl-benzoyl)-5-methyl-norcarane-2,4-quinone Formula: C18H19BrO6S MolecularWeight: 443.30886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1OC)S(=O)(=O)C)C(=O)C2C(=O)C3CC3C(C2=O)(C)Br

Isomeric SMILES

CC1=C(C=CC(=C1OC)S(=O)(=O)C)C(=O)C2C(=O)C3CC3C(C2=O)(C)Br

InChI

InChI=1S/C18H19BrO6S/c1-8-9(5-6-12(16(8)25-3)26(4,23)24)14(20)13-15(21)10-7-11(10)18(2,19)17(13)22/h5-6,10-11,13H,7H2,1-4H3