5-(3,5-dimethoxyphenyl)-6-(4-methylsulfonylphenyl)-1,3-benzodioxole

Systemtic Name: 5-(3,5-dimethoxyphenyl)-6-(4-methylsulfonylphenyl)-1,3-benzodioxole Openeye Name: 5-(3,5-dimethoxyphenyl)-6-(4-methylsulfonylphenyl)-1,3-benzodioxole CAS Name: 5-(3,5-dimethoxyphenyl)-6-(4-methylsulfonylphenyl)-1,3-benzodioxole IUPAC Name: 5-(3,5-dimethoxyphenyl)-6-(4-methylsulfonylphenyl)-1,3-benzodioxole Traditional Name: 5-(3,5-dimethoxyphenyl)-6-(4-mesylphenyl)-1,3-benzodioxole Formula: C22H20O6S MolecularWeight: 412.4556

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C2=CC3=C(C=C2C4=CC=C(C=C4)S(=O)(=O)C)OCO3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C2=CC3=C(C=C2C4=CC=C(C=C4)S(=O)(=O)C)OCO3)OC

InChI

InChI=1S/C22H20O6S/c1-25-16-8-15(9-17(10-16)26-2)20-12-22-21(27-13-28-22)11-19(20)14-4-6-18(7-5-14)29(3,23)24/h4-12H,13H2,1-3H3