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

Systemtic Name: 3-[(4-bromanyl-2-nitro-phenyl)sulfamoyl]propanoic acid Openeye Name: 3-[(4-bromo-2-nitro-phenyl)sulfamoyl]propanoic acid CAS Name: 3-[(4-bromo-2-nitrophenyl)sulfamoyl]propanoic acid IUPAC Name: 3-[(4-bromo-2-nitrophenyl)sulfamoyl]propanoic acid Traditional Name: 3-[(4-bromo-2-nitro-phenyl)sulfamoyl]propionic acid Formula: C9H9BrN2O6S MolecularWeight: 353.14656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)[N+](=O)[O-])NS(=O)(=O)CCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1Br)[N+](=O)[O-])NS(=O)(=O)CCC(=O)O

InChI

InChI=1S/C9H9BrN2O6S/c10-6-1-2-7(8(5-6)12(15)16)11-19(17,18)4-3-9(13)14/h1-2,5,11H,3-4H2,(H,13,14)