3-[3,4-bis(fluoranyl)phenyl]azanidylsulfonyl-5-fluoranyl-benzoate

Systemtic Name: 3-[3,4-bis(fluoranyl)phenyl]azanidylsulfonyl-5-fluoranyl-benzoate Openeye Name: 3-(3,4-difluorophenyl)azanidylsulfonyl-5-fluoro-benzoate CAS Name: 3-(3,4-difluorophenyl)azanidylsulfonyl-5-fluorobenzoate IUPAC Name: 3-(3,4-difluorophenyl)azanidylsulfonyl-5-fluorobenzoate Traditional Name: 3-(3,4-difluorophenyl)azanidylsulfonyl-5-fluoro-benzoate Formula: C13H6F3NO4S-2 MolecularWeight: 329.25125

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N-]S(=O)(=O)C2=CC(=CC(=C2)F)C(=O)[O-])F)F

Isomeric SMILES

C1=CC(=C(C=C1[N-]S(=O)(=O)C2=CC(=CC(=C2)F)C(=O)[O-])F)F

InChI

InChI=1S/C13H7F3NO4S/c14-8-3-7(13(18)19)4-10(5-8)22(20,21)17-9-1-2-11(15)12(16)6-9/h1-6H,(H,18,19)/q-1/p-1