1-[2,6-bis-(4-methylphenyl)sulfonylphenyl]propan-1-one

Systemtic Name: 1-[2,6-bis-(4-methylphenyl)sulfonylphenyl]propan-1-one Openeye Name: 1-[2,6-bis(p-tolylsulfonyl)phenyl]propan-1-one CAS Name: 1-[2,6-bis-(4-methylphenyl)sulfonylphenyl]-1-propanone IUPAC Name: 1-[2,6-bis-(4-methylphenyl)sulfonylphenyl]propan-1-one Traditional Name: 1-(2,6-ditosylphenyl)propan-1-one Formula: C23H22O5S2 MolecularWeight: 442.54778

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C=CC=C1S(=O)(=O)C2=CC=C(C=C2)C)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(=O)C1=C(C=CC=C1S(=O)(=O)C2=CC=C(C=C2)C)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H22O5S2/c1-4-20(24)23-21(29(25,26)18-12-8-16(2)9-13-18)6-5-7-22(23)30(27,28)19-14-10-17(3)11-15-19/h5-15H,4H2,1-3H3