4-[[3-(cyanomethoxy)phenyl]sulfamoyl]butanoic acid

Systemtic Name: 4-[[3-(cyanomethoxy)phenyl]sulfamoyl]butanoic acid Openeye Name: 4-[[3-(cyanomethoxy)phenyl]sulfamoyl]butanoic acid CAS Name: 4-[[3-(cyanomethoxy)phenyl]sulfamoyl]butanoic acid IUPAC Name: 4-[[3-(cyanomethoxy)phenyl]sulfamoyl]butanoic acid Traditional Name: 4-[[3-(cyanomethoxy)phenyl]sulfamoyl]butyric acid Formula: C12H14N2O5S MolecularWeight: 298.31496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC#N)NS(=O)(=O)CCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)OCC#N)NS(=O)(=O)CCCC(=O)O

InChI

InChI=1S/C12H14N2O5S/c13-6-7-19-11-4-1-3-10(9-11)14-20(17,18)8-2-5-12(15)16/h1,3-4,9,14H,2,5,7-8H2,(H,15,16)