3-nitro-4-(phenylsulfonylamino)benzoic acid

Systemtic Name: 3-nitro-4-(phenylsulfonylamino)benzoic acid Openeye Name: 4-(benzenesulfonamido)-3-nitro-benzoic acid CAS Name: 4-(benzenesulfonamido)-3-nitrobenzoic acid IUPAC Name: 4-(benzenesulfonamido)-3-nitrobenzoic acid Traditional Name: 4-(benzenesulfonamido)-3-nitro-benzoic acid Formula: C13H10N2O6S MolecularWeight: 322.2933

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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