3-[(2-nitro-4-sulfamoyl-phenyl)amino]propanoate

Systemtic Name: 3-[(2-nitro-4-sulfamoyl-phenyl)amino]propanoate Openeye Name: 3-(2-nitro-4-sulfamoyl-anilino)propanoate CAS Name: 3-(2-nitro-4-sulfamoylanilino)propanoate IUPAC Name: 3-(2-nitro-4-sulfamoylanilino)propanoate Traditional Name: 3-(2-nitro-4-sulfamoyl-anilino)propionate Formula: C9H10N3O6S- MolecularWeight: 288.2572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11N3O6S/c10-19(17,18)6-1-2-7(8(5-6)12(15)16)11-4-3-9(13)14/h1-2,5,11H,3-4H2,(H,13,14)(H2,10,17,18)/p-1