4-[(2-nitro-4-sulfamoyl-phenyl)amino]butanoic acid

Systemtic Name: 4-[(2-nitro-4-sulfamoyl-phenyl)amino]butanoic acid Openeye Name: 4-(2-nitro-4-sulfamoyl-anilino)butanoic acid CAS Name: 4-(2-nitro-4-sulfamoylanilino)butanoic acid IUPAC Name: 4-(2-nitro-4-sulfamoylanilino)butanoic acid Traditional Name: 4-(2-nitro-4-sulfamoyl-anilino)butyric acid Formula: C10H13N3O6S MolecularWeight: 303.29172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)N)[N+](=O)[O-])NCCCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)N)[N+](=O)[O-])NCCCC(=O)O

InChI

InChI=1S/C10H13N3O6S/c11-20(18,19)7-3-4-8(9(6-7)13(16)17)12-5-1-2-10(14)15/h3-4,6,12H,1-2,5H2,(H,14,15)(H2,11,18,19)