4-(methylamino)-3-nitro-5-sulfamoyl-benzoic acid

Systemtic Name: 4-(methylamino)-3-nitro-5-sulfamoyl-benzoic acid Openeye Name: 4-(methylamino)-3-nitro-5-sulfamoyl-benzoic acid CAS Name: 4-(methylamino)-3-nitro-5-sulfamoylbenzoic acid IUPAC Name: 4-(methylamino)-3-nitro-5-sulfamoylbenzoic acid Traditional Name: 4-(methylamino)-3-nitro-5-sulfamoyl-benzoic acid Formula: C8H9N3O6S MolecularWeight: 275.23856

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1S(=O)(=O)N)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1S(=O)(=O)N)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C8H9N3O6S/c1-10-7-5(11(14)15)2-4(8(12)13)3-6(7)18(9,16)17/h2-3,10H,1H3,(H,12,13)(H2,9,16,17)