Molecule ID: 5355967

IUPAC Name: (E)-3-(benzenesulfonyl)-1-phenylprop-2-en-1-one

Description: The molecule is a sulfone that is 1-phenyl-2-propenone with a phenylsulfonyl group at position 3. It has a role as a metabolite. It is a sulfone, an enone and an aromatic ketone.

SMILES: O=C(/C=C/S(=O)(=O)c1ccccc1)c1ccccc1

SELFIES: [O][=C][Branch2][Ring1][C][/C][=C][/S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1]

InChI: InChI=1S/C15H12O3S/c16-15(13-7-3-1-4-8-13)11-12-19(17,18)14-9-5-2-6-10-14/h1-12H/b12-11+

Molecular Properties:
- Polar Surface Area: 59.6 Ų
- LogP: 2.6