6-bromanyl-N-butyl-3-nitro-2-oxidanyl-benzenesulfonamide

Systemtic Name: 6-bromanyl-N-butyl-3-nitro-2-oxidanyl-benzenesulfonamide Openeye Name: 6-bromo-N-butyl-2-hydroxy-3-nitro-benzenesulfonamide CAS Name: 6-bromo-N-butyl-2-hydroxy-3-nitrobenzenesulfonamide IUPAC Name: 6-bromo-N-butyl-2-hydroxy-3-nitrobenzenesulfonamide Traditional Name: 6-bromo-N-butyl-2-hydroxy-3-nitro-benzenesulfonamide Formula: C10H13BrN2O5S MolecularWeight: 353.18962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=C(C=CC(=C1O)[N+](=O)[O-])Br

Isomeric SMILES

CCCCNS(=O)(=O)C1=C(C=CC(=C1O)[N+](=O)[O-])Br

InChI

InChI=1S/C10H13BrN2O5S/c1-2-3-6-12-19(17,18)10-7(11)4-5-8(9(10)14)13(15)16/h4-5,12,14H,2-3,6H2,1H3