N-(2-methyl-2-morpholin-4-yl-butyl)-5-[(3-nitrophenyl)sulfonylamino]-2-oxidanyl-benzamide

Systemtic Name: N-(2-methyl-2-morpholin-4-yl-butyl)-5-[(3-nitrophenyl)sulfonylamino]-2-oxidanyl-benzamide Openeye Name: 2-hydroxy-N-(2-methyl-2-morpholino-butyl)-5-[(3-nitrophenyl)sulfonylamino]benzamide CAS Name: 2-hydroxy-N-[2-methyl-2-(4-morpholinyl)butyl]-5-[(3-nitrophenyl)sulfonylamino]benzamide IUPAC Name: 2-hydroxy-N-(2-methyl-2-morpholin-4-ylbutyl)-5-[(3-nitrophenyl)sulfonylamino]benzamide Traditional Name: 2-hydroxy-N-(2-methyl-2-morpholino-butyl)-5-[(3-nitrophenyl)sulfonylamino]benzamide Formula: C22H28N4O7S MolecularWeight: 492.54532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CNC(=O)C1=C(C=CC(=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])O)N3CCOCC3

Isomeric SMILES

CCC(C)(CNC(=O)C1=C(C=CC(=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])O)N3CCOCC3

InChI

InChI=1S/C22H28N4O7S/c1-3-22(2,25-9-11-33-12-10-25)15-23-21(28)19-13-16(7-8-20(19)27)24-34(31,32)18-6-4-5-17(14-18)26(29)30/h4-8,13-14,24,27H,3,9-12,15H2,1-2H3,(H,23,28)