3-[4-(1H-pyrazol-4-ylsulfamoyl)phenyl]propanoic acid

Systemtic Name: 3-[4-(1H-pyrazol-4-ylsulfamoyl)phenyl]propanoic acid Openeye Name: 3-[4-(1H-pyrazol-4-ylsulfamoyl)phenyl]propanoic acid CAS Name: 3-[4-(1H-pyrazol-4-ylsulfamoyl)phenyl]propanoic acid IUPAC Name: 3-[4-(1H-pyrazol-4-ylsulfamoyl)phenyl]propanoic acid Traditional Name: 3-[4-(1H-pyrazol-4-ylsulfamoyl)phenyl]propionic acid Formula: C12H13N3O4S MolecularWeight: 295.31432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)O)S(=O)(=O)NC2=CNN=C2

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)O)S(=O)(=O)NC2=CNN=C2

InChI

InChI=1S/C12H13N3O4S/c16-12(17)6-3-9-1-4-11(5-2-9)20(18,19)15-10-7-13-14-8-10/h1-2,4-5,7-8,15H,3,6H2,(H,13,14)(H,16,17)