2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N,N-bis(2-methylpropyl)-5-nitro-benzenesulfonamide

Systemtic Name: 2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N,N-bis(2-methylpropyl)-5-nitro-benzenesulfonamide Openeye Name: 2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N,N-diisobutyl-5-nitro-benzenesulfonamide CAS Name: 2-[(2R,6R)-2,6-dimethyl-4-morpholinyl]-N,N-bis(2-methylpropyl)-5-nitrobenzenesulfonamide IUPAC Name: 2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N,N-bis(2-methylpropyl)-5-nitrobenzenesulfonamide Traditional Name: 2-[(2R,6R)-2,6-dimethylmorpholino]-N,N-diisobutyl-5-nitro-benzenesulfonamide Formula: C20H33N3O5S MolecularWeight: 427.55812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N(CC(C)C)CC(C)C

Isomeric SMILES

C[C@@H]1CN(C[C@H](O1)C)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N(CC(C)C)CC(C)C

InChI

InChI=1S/C20H33N3O5S/c1-14(2)10-22(11-15(3)4)29(26,27)20-9-18(23(24)25)7-8-19(20)21-12-16(5)28-17(6)13-21/h7-9,14-17H,10-13H2,1-6H3/t16-,17-/m1/s1