2-bromanyl-5-(pyridin-4-ylmethylsulfamoyl)benzoic acid

Systemtic Name: 2-bromanyl-5-(pyridin-4-ylmethylsulfamoyl)benzoic acid Openeye Name: 2-bromo-5-(4-pyridylmethylsulfamoyl)benzoic acid CAS Name: 2-bromo-5-(pyridin-4-ylmethylsulfamoyl)benzoic acid IUPAC Name: 2-bromo-5-(pyridin-4-ylmethylsulfamoyl)benzoic acid Traditional Name: 2-bromo-5-(4-pyridylmethylsulfamoyl)benzoic acid Formula: C13H11BrN2O4S MolecularWeight: 371.20644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)NCC2=CC=NC=C2)C(=O)O)Br

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)NCC2=CC=NC=C2)C(=O)O)Br

InChI

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