N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-2-morpholino-5-nitro-benzamide CAS Name: N-[3-(diethylsulfamoyl)-4-methylphenyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[3-(diethylsulfamoyl)-4-methylphenyl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-2-morpholino-5-nitro-benzamide Formula: C22H28N4O6S MolecularWeight: 476.54592

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)C

InChI

InChI=1S/C22H28N4O6S/c1-4-25(5-2)33(30,31)21-14-17(7-6-16(21)3)23-22(27)19-15-18(26(28)29)8-9-20(19)24-10-12-32-13-11-24/h6-9,14-15H,4-5,10-13H2,1-3H3,(H,23,27)