N-[5-(2-methylbutan-2-yl)-2-oxidanyl-phenyl]-1-(2-nitrophenyl)methanesulfonamide

Systemtic Name: N-[5-(2-methylbutan-2-yl)-2-oxidanyl-phenyl]-1-(2-nitrophenyl)methanesulfonamide Openeye Name: N-[5-(1,1-dimethylpropyl)-2-hydroxy-phenyl]-1-(2-nitrophenyl)methanesulfonamide CAS Name: N-[2-hydroxy-5-(2-methylbutan-2-yl)phenyl]-1-(2-nitrophenyl)methanesulfonamide IUPAC Name: N-[2-hydroxy-5-(2-methylbutan-2-yl)phenyl]-1-(2-nitrophenyl)methanesulfonamide Traditional Name: N-(5-tert-amyl-2-hydroxy-phenyl)-1-(2-nitrophenyl)methanesulfonamide Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)O)NS(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)O)NS(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C18H22N2O5S/c1-4-18(2,3)14-9-10-17(21)15(11-14)19-26(24,25)12-13-7-5-6-8-16(13)20(22)23/h5-11,19,21H,4,12H2,1-3H3