4-bromanyl-N-(4-methoxy-3-oxidanyl-phenyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-bromanyl-N-(4-methoxy-3-oxidanyl-phenyl)-3-nitro-benzenesulfonamide Openeye Name: 4-bromo-N-(3-hydroxy-4-methoxy-phenyl)-3-nitro-benzenesulfonamide CAS Name: 4-bromo-N-(3-hydroxy-4-methoxyphenyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-bromo-N-(3-hydroxy-4-methoxyphenyl)-3-nitrobenzenesulfonamide Traditional Name: 4-bromo-N-(3-hydroxy-4-methoxy-phenyl)-3-nitro-benzenesulfonamide Formula: C13H11BrN2O6S MolecularWeight: 403.20524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-])O

Isomeric SMILES

COC1=C(C=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-])O

InChI

InChI=1S/C13H11BrN2O6S/c1-22-13-5-2-8(6-12(13)17)15-23(20,21)9-3-4-10(14)11(7-9)16(18)19/h2-7,15,17H,1H3