N-(2-bromanyl-4-methyl-phenyl)-3-nitro-4-oxidanyl-benzenesulfonamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-3-nitro-4-oxidanyl-benzenesulfonamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-4-hydroxy-3-nitro-benzenesulfonamide CAS Name: N-(2-bromo-4-methylphenyl)-4-hydroxy-3-nitrobenzenesulfonamide IUPAC Name: N-(2-bromo-4-methylphenyl)-4-hydroxy-3-nitrobenzenesulfonamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-4-hydroxy-3-nitro-benzenesulfonamide Formula: C13H11BrN2O5S MolecularWeight: 387.20584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-])Br

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-])Br

InChI

InChI=1S/C13H11BrN2O5S/c1-8-2-4-11(10(14)6-8)15-22(20,21)9-3-5-13(17)12(7-9)16(18)19/h2-7,15,17H,1H3