N-(5-bromanyl-2-methyl-4-oxidanyl-phenyl)-3-nitro-benzenesulfonamide

Systemtic Name: N-(5-bromanyl-2-methyl-4-oxidanyl-phenyl)-3-nitro-benzenesulfonamide Openeye Name: N-(5-bromo-4-hydroxy-2-methyl-phenyl)-3-nitro-benzenesulfonamide CAS Name: N-(5-bromo-4-hydroxy-2-methylphenyl)-3-nitrobenzenesulfonamide IUPAC Name: N-(5-bromo-4-hydroxy-2-methylphenyl)-3-nitrobenzenesulfonamide Traditional Name: N-(5-bromo-4-hydroxy-2-methyl-phenyl)-3-nitro-benzenesulfonamide Formula: C13H11BrN2O5S MolecularWeight: 387.20584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])Br)O

Isomeric SMILES

CC1=CC(=C(C=C1NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])Br)O

InChI

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