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

Systemtic Name: 6-(4-methylsulfonylphenyl)-1,3-benzodioxole-5-carbaldehyde Openeye Name: 6-(4-methylsulfonylphenyl)-1,3-benzodioxole-5-carbaldehyde CAS Name: 6-(4-methylsulfonylphenyl)-1,3-benzodioxole-5-carboxaldehyde IUPAC Name: 6-(4-methylsulfonylphenyl)-1,3-benzodioxole-5-carbaldehyde Traditional Name: 6-(4-mesylphenyl)piperonal Formula: C15H12O5S MolecularWeight: 304.31778

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CC3=C(C=C2C=O)OCO3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CC3=C(C=C2C=O)OCO3

InChI

InChI=1S/C15H12O5S/c1-21(17,18)12-4-2-10(3-5-12)13-7-15-14(19-9-20-15)6-11(13)8-16/h2-8H,9H2,1H3