4-methylsulfonyl-3-(nitromethylsulfonyl)-2-phenyl-benzenesulfonamide

Systemtic Name: 4-methylsulfonyl-3-(nitromethylsulfonyl)-2-phenyl-benzenesulfonamide Openeye Name: 4-methylsulfonyl-3-(nitromethylsulfonyl)-2-phenyl-benzenesulfonamide CAS Name: 4-methylsulfonyl-3-(nitromethylsulfonyl)-2-phenylbenzenesulfonamide IUPAC Name: 4-methylsulfonyl-3-(nitromethylsulfonyl)-2-phenylbenzenesulfonamide Traditional Name: 4-mesyl-3-(nitromethylsulfonyl)-2-phenyl-benzenesulfonamide Formula: C14H14N2O8S3 MolecularWeight: 434.46456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N2O8S3/c1-25(19,20)12-8-7-11(27(15,23)24)13(10-5-3-2-4-6-10)14(12)26(21,22)9-16(17)18/h2-8H,9H2,1H3,(H2,15,23,24)