3-nitro-N-[4-oxidanyl-3,5-di(propan-2-yl)phenyl]benzenesulfonamide

Systemtic Name: 3-nitro-N-[4-oxidanyl-3,5-di(propan-2-yl)phenyl]benzenesulfonamide Openeye Name: N-(4-hydroxy-3,5-diisopropyl-phenyl)-3-nitro-benzenesulfonamide CAS Name: N-[4-hydroxy-3,5-di(propan-2-yl)phenyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[4-hydroxy-3,5-di(propan-2-yl)phenyl]-3-nitrobenzenesulfonamide Traditional Name: N-(4-hydroxy-3,5-diisopropyl-phenyl)-3-nitro-benzenesulfonamide Formula: C18H22N2O5S MolecularWeight: 378.44268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O5S/c1-11(2)16-8-13(9-17(12(3)4)18(16)21)19-26(24,25)15-7-5-6-14(10-15)20(22)23/h5-12,19,21H,1-4H3