N-[4-(diethylsulfamoyl)phenyl]-4-morpholin-4-yl-3,5-dinitro-benzamide

Systemtic Name: N-[4-(diethylsulfamoyl)phenyl]-4-morpholin-4-yl-3,5-dinitro-benzamide Openeye Name: N-[4-(diethylsulfamoyl)phenyl]-4-morpholino-3,5-dinitro-benzamide CAS Name: N-[4-(diethylsulfamoyl)phenyl]-4-(4-morpholinyl)-3,5-dinitrobenzamide IUPAC Name: N-[4-(diethylsulfamoyl)phenyl]-4-morpholin-4-yl-3,5-dinitrobenzamide Traditional Name: N-[4-(diethylsulfamoyl)phenyl]-4-morpholino-3,5-dinitro-benzamide Formula: C21H25N5O8S MolecularWeight: 507.5169

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N5O8S/c1-3-24(4-2)35(32,33)17-7-5-16(6-8-17)22-21(27)15-13-18(25(28)29)20(19(14-15)26(30)31)23-9-11-34-12-10-23/h5-8,13-14H,3-4,9-12H2,1-2H3,(H,22,27)