3-[[4-(cyanomethyl)phenyl]sulfamoyl]propanoic acid

Systemtic Name: 3-[[4-(cyanomethyl)phenyl]sulfamoyl]propanoic acid Openeye Name: 3-[[4-(cyanomethyl)phenyl]sulfamoyl]propanoic acid CAS Name: 3-[[4-(cyanomethyl)phenyl]sulfamoyl]propanoic acid IUPAC Name: 3-[[4-(cyanomethyl)phenyl]sulfamoyl]propanoic acid Traditional Name: 3-[[4-(cyanomethyl)phenyl]sulfamoyl]propionic acid Formula: C11H12N2O4S MolecularWeight: 268.28898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)NS(=O)(=O)CCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1CC#N)NS(=O)(=O)CCC(=O)O

InChI

InChI=1S/C11H12N2O4S/c12-7-5-9-1-3-10(4-2-9)13-18(16,17)8-6-11(14)15/h1-4,13H,5-6,8H2,(H,14,15)