5-bromanyl-4-tert-butyl-3-nitro-2-oxidanyl-benzenesulfonamide

Systemtic Name: 5-bromanyl-4-tert-butyl-3-nitro-2-oxidanyl-benzenesulfonamide Openeye Name: 5-bromo-4-tert-butyl-2-hydroxy-3-nitro-benzenesulfonamide CAS Name: 5-bromo-4-tert-butyl-2-hydroxy-3-nitrobenzenesulfonamide IUPAC Name: 5-bromo-4-tert-butyl-2-hydroxy-3-nitrobenzenesulfonamide Traditional Name: 5-bromo-4-tert-butyl-2-hydroxy-3-nitro-benzenesulfonamide Formula: C10H13BrN2O5S MolecularWeight: 353.18962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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