4-butan-2-yl-N-(4-nitro-2-oxidanyl-phenyl)benzenesulfonamide

Systemtic Name: 4-butan-2-yl-N-(4-nitro-2-oxidanyl-phenyl)benzenesulfonamide Openeye Name: N-(2-hydroxy-4-nitro-phenyl)-4-sec-butyl-benzenesulfonamide CAS Name: 4-butan-2-yl-N-(2-hydroxy-4-nitrophenyl)benzenesulfonamide IUPAC Name: 4-butan-2-yl-N-(2-hydroxy-4-nitrophenyl)benzenesulfonamide Traditional Name: N-(2-hydroxy-4-nitro-phenyl)-4-sec-butyl-benzenesulfonamide Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O5S/c1-3-11(2)12-4-7-14(8-5-12)24(22,23)17-15-9-6-13(18(20)21)10-16(15)19/h4-11,17,19H,3H2,1-2H3