3-(3-methoxy-2-methyl-4-methylsulfonyl-phenyl)carbonyl-2-phenylsulfanyl-bicyclo[3.2.1]oct-2-en-4-one

Systemtic Name: 3-(3-methoxy-2-methyl-4-methylsulfonyl-phenyl)carbonyl-2-phenylsulfanyl-bicyclo[3.2.1]oct-2-en-4-one Openeye Name: 3-(3-methoxy-2-methyl-4-methylsulfonyl-benzoyl)-2-phenylsulfanyl-bicyclo[3.2.1]oct-2-en-4-one CAS Name: 3-[(3-methoxy-2-methyl-4-methylsulfonylphenyl)-oxomethyl]-2-(phenylthio)-4-bicyclo[3.2.1]oct-2-enone IUPAC Name: 3-(3-methoxy-2-methyl-4-methylsulfonylbenzoyl)-2-phenylsulfanylbicyclo[3.2.1]oct-2-en-4-one Traditional Name: 3-(4-mesyl-3-methoxy-2-methyl-benzoyl)-2-(phenylthio)bicyclo[3.2.1]oct-2-en-4-one Formula: C24H24O5S2 MolecularWeight: 456.57436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1OC)S(=O)(=O)C)C(=O)C2=C(C3CCC(C3)C2=O)SC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1OC)S(=O)(=O)C)C(=O)C2=C(C3CCC(C3)C2=O)SC4=CC=CC=C4

InChI

InChI=1S/C24H24O5S2/c1-14-18(11-12-19(23(14)29-2)31(3,27)28)22(26)20-21(25)15-9-10-16(13-15)24(20)30-17-7-5-4-6-8-17/h4-8,11-12,15-16H,9-10,13H2,1-3H3