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

Systemtic Name: N-(2,5-diethoxy-4-morpholin-4-yl-phenyl)-3-nitro-benzamide Openeye Name: N-(2,5-diethoxy-4-morpholino-phenyl)-3-nitro-benzamide CAS Name: N-[2,5-diethoxy-4-(4-morpholinyl)phenyl]-3-nitrobenzamide IUPAC Name: N-(2,5-diethoxy-4-morpholin-4-ylphenyl)-3-nitrobenzamide Traditional Name: N-(2,5-diethoxy-4-morpholino-phenyl)-3-nitro-benzamide Formula: C21H25N3O6 MolecularWeight: 415.4397

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O6/c1-3-29-19-14-18(23-8-10-28-11-9-23)20(30-4-2)13-17(19)22-21(25)15-6-5-7-16(12-15)24(26)27/h5-7,12-14H,3-4,8-11H2,1-2H3,(H,22,25)