N-(4-methylsulfonylphenyl)-2-nitro-benzenesulfonamide

Systemtic Name: N-(4-methylsulfonylphenyl)-2-nitro-benzenesulfonamide Openeye Name: N-(4-methylsulfonylphenyl)-2-nitro-benzenesulfonamide CAS Name: N-(4-methylsulfonylphenyl)-2-nitrobenzenesulfonamide IUPAC Name: N-(4-methylsulfonylphenyl)-2-nitrobenzenesulfonamide Traditional Name: N-(4-mesylphenyl)-2-nitro-benzenesulfonamide Formula: C13H12N2O6S2 MolecularWeight: 356.37418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N2O6S2/c1-22(18,19)11-8-6-10(7-9-11)14-23(20,21)13-5-3-2-4-12(13)15(16)17/h2-9,14H,1H3