3-bromanyl-5-(pyridin-3-ylmethylsulfamoyl)benzoate

Systemtic Name: 3-bromanyl-5-(pyridin-3-ylmethylsulfamoyl)benzoate Openeye Name: 3-bromo-5-(3-pyridylmethylsulfamoyl)benzoate CAS Name: 3-bromo-5-(3-pyridinylmethylsulfamoyl)benzoate IUPAC Name: 3-bromo-5-(pyridin-3-ylmethylsulfamoyl)benzoate Traditional Name: 3-bromo-5-(3-pyridylmethylsulfamoyl)benzoate Formula: C13H10BrN2O4S- MolecularWeight: 370.1985

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNS(=O)(=O)C2=CC(=CC(=C2)C(=O)[O-])Br

Isomeric SMILES

C1=CC(=CN=C1)CNS(=O)(=O)C2=CC(=CC(=C2)C(=O)[O-])Br

InChI

InChI=1S/C13H11BrN2O4S/c14-11-4-10(13(17)18)5-12(6-11)21(19,20)16-8-9-2-1-3-15-7-9/h1-7,16H,8H2,(H,17,18)/p-1