N-(4-methylsulfonylphenyl)-3-nitro-benzenesulfonamide

Systemtic Name: N-(4-methylsulfonylphenyl)-3-nitro-benzenesulfonamide Openeye Name: N-(4-methylsulfonylphenyl)-3-nitro-benzenesulfonamide CAS Name: N-(4-methylsulfonylphenyl)-3-nitrobenzenesulfonamide IUPAC Name: N-(4-methylsulfonylphenyl)-3-nitrobenzenesulfonamide Traditional Name: N-(4-mesylphenyl)-3-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)12-7-5-10(6-8-12)14-23(20,21)13-4-2-3-11(9-13)15(16)17/h2-9,14H,1H3