3-nitro-5-(phenylsulfamoyl)benzoic acid

Systemtic Name: 3-nitro-5-(phenylsulfamoyl)benzoic acid Openeye Name: 3-nitro-5-(phenylsulfamoyl)benzoic acid CAS Name: 3-nitro-5-(phenylsulfamoyl)benzoic acid IUPAC Name: 3-nitro-5-(phenylsulfamoyl)benzoic acid Traditional Name: 3-nitro-5-(phenylsulfamoyl)benzoic acid Formula: C13H10N2O6S MolecularWeight: 322.2933

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N2O6S/c16-13(17)9-6-11(15(18)19)8-12(7-9)22(20,21)14-10-4-2-1-3-5-10/h1-8,14H,(H,16,17)