3-[(4-nitro-2-oxidanyl-phenyl)sulfamoyl]benzoic acid

Systemtic Name: 3-[(4-nitro-2-oxidanyl-phenyl)sulfamoyl]benzoic acid Openeye Name: 3-[(2-hydroxy-4-nitro-phenyl)sulfamoyl]benzoic acid CAS Name: 3-[(2-hydroxy-4-nitrophenyl)sulfamoyl]benzoic acid IUPAC Name: 3-[(2-hydroxy-4-nitrophenyl)sulfamoyl]benzoic acid Traditional Name: 3-[(2-hydroxy-4-nitro-phenyl)sulfamoyl]benzoic acid Formula: C13H10N2O7S MolecularWeight: 338.2927

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])O)C(=O)O

InChI

InChI=1S/C13H10N2O7S/c16-12-7-9(15(19)20)4-5-11(12)14-23(21,22)10-3-1-2-8(6-10)13(17)18/h1-7,14,16H,(H,17,18)