2,6-bis(fluoranyl)-3-(4-oxidanylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: 2,6-bis(fluoranyl)-3-(4-oxidanylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: 2,6-difluoro-3-[(4-hydroxy-1-piperidyl)sulfonyl]benzoate CAS Name: 2,6-difluoro-3-[(4-hydroxy-1-piperidinyl)sulfonyl]benzoate IUPAC Name: 2,6-difluoro-3-(4-hydroxypiperidin-1-yl)sulfonylbenzoate Traditional Name: 2,6-difluoro-3-(4-hydroxypiperidino)sulfonyl-benzoate Formula: C12H12F2NO5S- MolecularWeight: 320.289186

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)S(=O)(=O)C2=C(C(=C(C=C2)F)C(=O)[O-])F

Isomeric SMILES

C1CN(CCC1O)S(=O)(=O)C2=C(C(=C(C=C2)F)C(=O)[O-])F

InChI

InChI=1S/C12H13F2NO5S/c13-8-1-2-9(11(14)10(8)12(17)18)21(19,20)15-5-3-7(16)4-6-15/h1-2,7,16H,3-6H2,(H,17,18)/p-1