1,3-bis(4-methylsulfonylphenyl)prop-2-yn-1-one

Systemtic Name: 1,3-bis(4-methylsulfonylphenyl)prop-2-yn-1-one Openeye Name: 1,3-bis(4-methylsulfonylphenyl)prop-2-yn-1-one CAS Name: 1,3-bis(4-methylsulfonylphenyl)-2-propyn-1-one IUPAC Name: 1,3-bis(4-methylsulfonylphenyl)prop-2-yn-1-one Traditional Name: 1,3-bis(4-mesylphenyl)prop-2-yn-1-one Formula: C17H14O5S2 MolecularWeight: 362.42006

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C#CC(=O)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C#CC(=O)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C17H14O5S2/c1-23(19,20)15-8-3-13(4-9-15)5-12-17(18)14-6-10-16(11-7-14)24(2,21)22/h3-4,6-11H,1-2H3