2-[(Z)-3,4-bis(phenylsulfonyl)but-2-enyl]cyclopentan-1-one

Systemtic Name: 2-[(Z)-3,4-bis(phenylsulfonyl)but-2-enyl]cyclopentan-1-one Openeye Name: 2-[(Z)-3,4-bis(benzenesulfonyl)but-2-enyl]cyclopentanone CAS Name: 2-[(Z)-3,4-bis(benzenesulfonyl)but-2-enyl]-1-cyclopentanone IUPAC Name: 2-[(Z)-3,4-bis(benzenesulfonyl)but-2-enyl]cyclopentan-1-one Traditional Name: 2-[(Z)-3,4-dibesylbut-2-enyl]cyclopentanone Formula: C21H22O5S2 MolecularWeight: 418.52638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)C1)CC=C(CS(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CC(C(=O)C1)C/C=C(/CS(=O)(=O)C2=CC=CC=C2)\S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22O5S2/c22-21-13-7-8-17(21)14-15-20(28(25,26)19-11-5-2-6-12-19)16-27(23,24)18-9-3-1-4-10-18/h1-6,9-12,15,17H,7-8,13-14,16H2/b20-15-