5-(2-bromanyl-4-ethoxycarbonyl-phenyl)sulfonylazanidyl-2-fluoranyl-benzoate

Systemtic Name: 5-(2-bromanyl-4-ethoxycarbonyl-phenyl)sulfonylazanidyl-2-fluoranyl-benzoate Openeye Name: 5-(2-bromo-4-ethoxycarbonyl-phenyl)sulfonylazanidyl-2-fluoro-benzoate CAS Name: 5-(2-bromo-4-ethoxycarbonylphenyl)sulfonylazanidyl-2-fluorobenzoate IUPAC Name: 5-(2-bromo-4-ethoxycarbonylphenyl)sulfonylazanidyl-2-fluorobenzoate Traditional Name: 5-(2-bromo-4-carbethoxy-phenyl)sulfonylazanidyl-2-fluoro-benzoate Formula: C16H11BrFNO6S-2 MolecularWeight: 444.229043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12BrFNO6S/c1-2-25-16(22)9-3-6-14(12(17)7-9)26(23,24)19-10-4-5-13(18)11(8-10)15(20)21/h3-8H,2H2,1H3,(H,20,21)/q-1/p-1