2-bromanyl-5-(pyridin-3-ylmethylsulfamoyl)benzoic acid

Systemtic Name: 2-bromanyl-5-(pyridin-3-ylmethylsulfamoyl)benzoic acid Openeye Name: 2-bromo-5-(3-pyridylmethylsulfamoyl)benzoic acid CAS Name: 2-bromo-5-(3-pyridinylmethylsulfamoyl)benzoic acid IUPAC Name: 2-bromo-5-(pyridin-3-ylmethylsulfamoyl)benzoic acid Traditional Name: 2-bromo-5-(3-pyridylmethylsulfamoyl)benzoic acid Formula: C13H11BrN2O4S MolecularWeight: 371.20644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNS(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)O

Isomeric SMILES

C1=CC(=CN=C1)CNS(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)O

InChI

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