3-[4-(pyrazin-2-ylsulfamoyl)phenyl]propanoic acid

Systemtic Name: 3-[4-(pyrazin-2-ylsulfamoyl)phenyl]propanoic acid Openeye Name: 3-[4-(pyrazin-2-ylsulfamoyl)phenyl]propanoic acid CAS Name: 3-[4-(2-pyrazinylsulfamoyl)phenyl]propanoic acid IUPAC Name: 3-[4-(pyrazin-2-ylsulfamoyl)phenyl]propanoic acid Traditional Name: 3-[4-(pyrazin-2-ylsulfamoyl)phenyl]propionic acid Formula: C13H13N3O4S MolecularWeight: 307.32502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)O)S(=O)(=O)NC2=NC=CN=C2

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)O)S(=O)(=O)NC2=NC=CN=C2

InChI

InChI=1S/C13H13N3O4S/c17-13(18)6-3-10-1-4-11(5-2-10)21(19,20)16-12-9-14-7-8-15-12/h1-2,4-5,7-9H,3,6H2,(H,15,16)(H,17,18)