3,5-ditert-butyl-N-(4-nitro-2-sulfamoyl-phenyl)-4-oxidanyl-benzamide

Systemtic Name: 3,5-ditert-butyl-N-(4-nitro-2-sulfamoyl-phenyl)-4-oxidanyl-benzamide Openeye Name: 3,5-ditert-butyl-4-hydroxy-N-(4-nitro-2-sulfamoyl-phenyl)benzamide CAS Name: 3,5-ditert-butyl-4-hydroxy-N-(4-nitro-2-sulfamoylphenyl)benzamide IUPAC Name: 3,5-ditert-butyl-4-hydroxy-N-(4-nitro-2-sulfamoylphenyl)benzamide Traditional Name: 3,5-ditert-butyl-4-hydroxy-N-(4-nitro-2-sulfamoyl-phenyl)benzamide Formula: C21H27N3O6S MolecularWeight: 449.52058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N

InChI

InChI=1S/C21H27N3O6S/c1-20(2,3)14-9-12(10-15(18(14)25)21(4,5)6)19(26)23-16-8-7-13(24(27)28)11-17(16)31(22,29)30/h7-11,25H,1-6H3,(H,23,26)(H2,22,29,30)