ethyl (E)-7,7-bis(fluoranyl)-7-(phenylsulfonyl)hept-5-enoate

Systemtic Name: ethyl (E)-7,7-bis(fluoranyl)-7-(phenylsulfonyl)hept-5-enoate Openeye Name: ethyl (E)-7-(benzenesulfonyl)-7,7-difluoro-hept-5-enoate CAS Name: (E)-7-(benzenesulfonyl)-7,7-difluoro-5-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-(benzenesulfonyl)-7,7-difluorohept-5-enoate Traditional Name: (E)-7-besyl-7,7-difluoro-hept-5-enoic acid ethyl ester Formula: C15H18F2O4S MolecularWeight: 332.362826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCC=CC(F)(F)S(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CCOC(=O)CCC/C=C/C(F)(F)S(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C15H18F2O4S/c1-2-21-14(18)11-7-4-8-12-15(16,17)22(19,20)13-9-5-3-6-10-13/h3,5-6,8-10,12H,2,4,7,11H2,1H3/b12-8+