4-tert-butyl-N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]-2,6-dimethyl-benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]-2,6-dimethyl-benzenesulfonamide Openeye Name: 4-tert-butyl-N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]-2,6-dimethyl-benzenesulfonamide CAS Name: 4-tert-butyl-N-[2-(2-hydroxyethylamino)-5-nitrophenyl]-2,6-dimethylbenzenesulfonamide IUPAC Name: 4-tert-butyl-N-[2-(2-hydroxyethylamino)-5-nitrophenyl]-2,6-dimethylbenzenesulfonamide Traditional Name: 4-tert-butyl-N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]-2,6-dimethyl-benzenesulfonamide Formula: C20H27N3O5S MolecularWeight: 421.51048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])NCCO)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])NCCO)C)C(C)(C)C

InChI

InChI=1S/C20H27N3O5S/c1-13-10-15(20(3,4)5)11-14(2)19(13)29(27,28)22-18-12-16(23(25)26)6-7-17(18)21-8-9-24/h6-7,10-12,21-22,24H,8-9H2,1-5H3