2-[[4-(methylsulfamoyl)-2-nitro-phenyl]amino]propanoic acid

Systemtic Name: 2-[[4-(methylsulfamoyl)-2-nitro-phenyl]amino]propanoic acid Openeye Name: 2-[4-(methylsulfamoyl)-2-nitro-anilino]propanoic acid CAS Name: 2-[4-(methylsulfamoyl)-2-nitroanilino]propanoic acid IUPAC Name: 2-[4-(methylsulfamoyl)-2-nitroanilino]propanoic acid Traditional Name: 2-[4-(methylsulfamoyl)-2-nitro-anilino]propionic acid Formula: C10H13N3O6S MolecularWeight: 303.29172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC1=C(C=C(C=C1)S(=O)(=O)NC)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)O)NC1=C(C=C(C=C1)S(=O)(=O)NC)[N+](=O)[O-]

InChI

InChI=1S/C10H13N3O6S/c1-6(10(14)15)12-8-4-3-7(20(18,19)11-2)5-9(8)13(16)17/h3-6,11-12H,1-2H3,(H,14,15)