3,3-bis(fluoranyl)-2-(phenylsulfonyl)heptan-4-one

Systemtic Name: 3,3-bis(fluoranyl)-2-(phenylsulfonyl)heptan-4-one Openeye Name: 2-(benzenesulfonyl)-3,3-difluoro-heptan-4-one CAS Name: 2-(benzenesulfonyl)-3,3-difluoro-4-heptanone IUPAC Name: 2-(benzenesulfonyl)-3,3-difluoroheptan-4-one Traditional Name: 2-besyl-3,3-difluoro-heptan-4-one Formula: C13H16F2O3S MolecularWeight: 290.326146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16F2O3S/c1-3-7-12(16)13(14,15)10(2)19(17,18)11-8-5-4-6-9-11/h4-6,8-10H,3,7H2,1-2H3