N-(2,5-diethoxy-4-morpholin-4-yl-phenyl)-4-nitro-3-oxidanyl-benzamide

Systemtic Name: N-(2,5-diethoxy-4-morpholin-4-yl-phenyl)-4-nitro-3-oxidanyl-benzamide Openeye Name: N-(2,5-diethoxy-4-morpholino-phenyl)-3-hydroxy-4-nitro-benzamide CAS Name: N-[2,5-diethoxy-4-(4-morpholinyl)phenyl]-3-hydroxy-4-nitrobenzamide IUPAC Name: N-(2,5-diethoxy-4-morpholin-4-ylphenyl)-3-hydroxy-4-nitrobenzamide Traditional Name: N-(2,5-diethoxy-4-morpholino-phenyl)-3-hydroxy-4-nitro-benzamide Formula: C21H25N3O7 MolecularWeight: 431.4391

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1N2CCOCC2)OCC)NC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

CCOC1=CC(=C(C=C1N2CCOCC2)OCC)NC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C21H25N3O7/c1-3-30-19-13-17(23-7-9-29-10-8-23)20(31-4-2)12-15(19)22-21(26)14-5-6-16(24(27)28)18(25)11-14/h5-6,11-13,25H,3-4,7-10H2,1-2H3,(H,22,26)