5-(4-methoxy-3-methyl-phenyl)-6-(4-methylsulfonylphenyl)-1,3-benzodioxole

Systemtic Name: 5-(4-methoxy-3-methyl-phenyl)-6-(4-methylsulfonylphenyl)-1,3-benzodioxole Openeye Name: 5-(4-methoxy-3-methyl-phenyl)-6-(4-methylsulfonylphenyl)-1,3-benzodioxole CAS Name: 5-(4-methoxy-3-methylphenyl)-6-(4-methylsulfonylphenyl)-1,3-benzodioxole IUPAC Name: 5-(4-methoxy-3-methylphenyl)-6-(4-methylsulfonylphenyl)-1,3-benzodioxole Traditional Name: 5-(4-mesylphenyl)-6-(4-methoxy-3-methyl-phenyl)-1,3-benzodioxole Formula: C22H20O5S MolecularWeight: 396.4562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC3=C(C=C2C4=CC=C(C=C4)S(=O)(=O)C)OCO3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC3=C(C=C2C4=CC=C(C=C4)S(=O)(=O)C)OCO3)OC

InChI

InChI=1S/C22H20O5S/c1-14-10-16(6-9-20(14)25-2)19-12-22-21(26-13-27-22)11-18(19)15-4-7-17(8-5-15)28(3,23)24/h4-12H,13H2,1-3H3