3-[(2-bromanyl-4-cyano-phenyl)sulfamoyl]propanoic acid

Systemtic Name: 3-[(2-bromanyl-4-cyano-phenyl)sulfamoyl]propanoic acid Openeye Name: 3-[(2-bromo-4-cyano-phenyl)sulfamoyl]propanoic acid CAS Name: 3-[(2-bromo-4-cyanophenyl)sulfamoyl]propanoic acid IUPAC Name: 3-[(2-bromo-4-cyanophenyl)sulfamoyl]propanoic acid Traditional Name: 3-[(2-bromo-4-cyano-phenyl)sulfamoyl]propionic acid Formula: C10H9BrN2O4S MolecularWeight: 333.15846

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)Br)NS(=O)(=O)CCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C#N)Br)NS(=O)(=O)CCC(=O)O

InChI

InChI=1S/C10H9BrN2O4S/c11-8-5-7(6-12)1-2-9(8)13-18(16,17)4-3-10(14)15/h1-2,5,13H,3-4H2,(H,14,15)