N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonyl-phenyl)-3-nitro-benzamide

Systemtic Name: N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonyl-phenyl)-3-nitro-benzamide Openeye Name: N-(2-morpholino-5-morpholinosulfonyl-phenyl)-3-nitro-benzamide CAS Name: N-[2-(4-morpholinyl)-5-(4-morpholinylsulfonyl)phenyl]-3-nitrobenzamide IUPAC Name: N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonylphenyl)-3-nitrobenzamide Traditional Name: N-(2-morpholino-5-morpholinosulfonyl-phenyl)-3-nitro-benzamide Formula: C21H24N4O7S MolecularWeight: 476.50286

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O7S/c26-21(16-2-1-3-17(14-16)25(27)28)22-19-15-18(33(29,30)24-8-12-32-13-9-24)4-5-20(19)23-6-10-31-11-7-23/h1-5,14-15H,6-13H2,(H,22,26)