3-nitro-4-(phenylsulfonyl)benzenesulfonic acid

Systemtic Name: 3-nitro-4-(phenylsulfonyl)benzenesulfonic acid Openeye Name: 4-(benzenesulfonyl)-3-nitro-benzenesulfonic acid CAS Name: 4-(benzenesulfonyl)-3-nitrobenzenesulfonic acid IUPAC Name: 4-(benzenesulfonyl)-3-nitrobenzenesulfonic acid Traditional Name: 4-besyl-3-nitro-besylic acid Formula: C12H9NO7S2 MolecularWeight: 343.33236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9NO7S2/c14-13(15)11-8-10(22(18,19)20)6-7-12(11)21(16,17)9-4-2-1-3-5-9/h1-8H,(H,18,19,20)