N-(2-hydroxyethyl)-3,4-dimethyl-5-nitro-N-propan-2-yl-benzenesulfonamide

Systemtic Name: N-(2-hydroxyethyl)-3,4-dimethyl-5-nitro-N-propan-2-yl-benzenesulfonamide Openeye Name: N-(2-hydroxyethyl)-N-isopropyl-3,4-dimethyl-5-nitro-benzenesulfonamide CAS Name: N-(2-hydroxyethyl)-3,4-dimethyl-5-nitro-N-propan-2-ylbenzenesulfonamide IUPAC Name: N-(2-hydroxyethyl)-3,4-dimethyl-5-nitro-N-propan-2-ylbenzenesulfonamide Traditional Name: N-(2-hydroxyethyl)-N-isopropyl-3,4-dimethyl-5-nitro-benzenesulfonamide Formula: C13H20N2O5S MolecularWeight: 316.3733

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)[N+](=O)[O-])S(=O)(=O)N(CCO)C(C)C

Isomeric SMILES

CC1=CC(=CC(=C1C)[N+](=O)[O-])S(=O)(=O)N(CCO)C(C)C

InChI

InChI=1S/C13H20N2O5S/c1-9(2)14(5-6-16)21(19,20)12-7-10(3)11(4)13(8-12)15(17)18/h7-9,16H,5-6H2,1-4H3