1-phenyl-4-(phenylsulfonyl)butane-1,3-dione

Systemtic Name: 1-phenyl-4-(phenylsulfonyl)butane-1,3-dione Openeye Name: 4-(benzenesulfonyl)-1-phenyl-butane-1,3-dione CAS Name: 4-(benzenesulfonyl)-1-phenylbutane-1,3-dione IUPAC Name: 4-(benzenesulfonyl)-1-phenylbutane-1,3-dione Traditional Name: 4-besyl-1-phenyl-butane-1,3-dione Formula: C16H14O4S MolecularWeight: 302.34496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14O4S/c17-14(11-16(18)13-7-3-1-4-8-13)12-21(19,20)15-9-5-2-6-10-15/h1-10H,11-12H2