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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

InChI

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