7,7-bis(fluoranyl)-5-iodanyl-7-(phenylsulfonyl)heptan-2-one

Systemtic Name: 7,7-bis(fluoranyl)-5-iodanyl-7-(phenylsulfonyl)heptan-2-one Openeye Name: 7-(benzenesulfonyl)-7,7-difluoro-5-iodo-heptan-2-one CAS Name: 7-(benzenesulfonyl)-7,7-difluoro-5-iodo-2-heptanone IUPAC Name: 7-(benzenesulfonyl)-7,7-difluoro-5-iodoheptan-2-one Traditional Name: 7-besyl-7,7-difluoro-5-iodo-heptan-2-one Formula: C13H15F2IO3S MolecularWeight: 416.222676

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(CC(F)(F)S(=O)(=O)C1=CC=CC=C1)I

Isomeric SMILES

CC(=O)CCC(CC(F)(F)S(=O)(=O)C1=CC=CC=C1)I

InChI

InChI=1S/C13H15F2IO3S/c1-10(17)7-8-11(16)9-13(14,15)20(18,19)12-5-3-2-4-6-12/h2-6,11H,7-9H2,1H3