3-cyano-N-(5-nitro-2-oxidanyl-phenyl)benzenesulfonamide

Systemtic Name: 3-cyano-N-(5-nitro-2-oxidanyl-phenyl)benzenesulfonamide Openeye Name: 3-cyano-N-(2-hydroxy-5-nitro-phenyl)benzenesulfonamide CAS Name: 3-cyano-N-(2-hydroxy-5-nitrophenyl)benzenesulfonamide IUPAC Name: 3-cyano-N-(2-hydroxy-5-nitrophenyl)benzenesulfonamide Traditional Name: 3-cyano-N-(2-hydroxy-5-nitro-phenyl)benzenesulfonamide Formula: C13H9N3O5S MolecularWeight: 319.29266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9N3O5S/c14-8-9-2-1-3-11(6-9)22(20,21)15-12-7-10(16(18)19)4-5-13(12)17/h1-7,15,17H