5-(4-bromanyl-2-fluoranyl-phenyl)azanidylsulfonyl-2-chloranyl-benzoate

Systemtic Name: 5-(4-bromanyl-2-fluoranyl-phenyl)azanidylsulfonyl-2-chloranyl-benzoate Openeye Name: 5-(4-bromo-2-fluoro-phenyl)azanidylsulfonyl-2-chloro-benzoate CAS Name: 5-(4-bromo-2-fluorophenyl)azanidylsulfonyl-2-chlorobenzoate IUPAC Name: 5-(4-bromo-2-fluorophenyl)azanidylsulfonyl-2-chlorobenzoate Traditional Name: 5-(4-bromo-2-fluoro-phenyl)azanidylsulfonyl-2-chloro-benzoate Formula: C13H6BrClFNO4S-2 MolecularWeight: 406.611443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)[N-]C2=C(C=C(C=C2)Br)F)C(=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)[N-]C2=C(C=C(C=C2)Br)F)C(=O)[O-])Cl

InChI

InChI=1S/C13H7BrClFNO4S/c14-7-1-4-12(11(16)5-7)17-22(20,21)8-2-3-10(15)9(6-8)13(18)19/h1-6H,(H,18,19)/q-1/p-1