3-bromanyl-N-(2-cyano-4-nitro-phenyl)benzenesulfonamide

Systemtic Name: 3-bromanyl-N-(2-cyano-4-nitro-phenyl)benzenesulfonamide Openeye Name: 3-bromo-N-(2-cyano-4-nitro-phenyl)benzenesulfonamide CAS Name: 3-bromo-N-(2-cyano-4-nitrophenyl)benzenesulfonamide IUPAC Name: 3-bromo-N-(2-cyano-4-nitrophenyl)benzenesulfonamide Traditional Name: 3-bromo-N-(2-cyano-4-nitro-phenyl)benzenesulfonamide Formula: C13H8BrN3O4S MolecularWeight: 382.18932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H8BrN3O4S/c14-10-2-1-3-12(7-10)22(20,21)16-13-5-4-11(17(18)19)6-9(13)8-15/h1-7,16H