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

Systemtic Name: 4-bromanyl-N-(2,5-diethoxy-4-morpholin-4-yl-phenyl)-3-nitro-benzamide Openeye Name: 4-bromo-N-(2,5-diethoxy-4-morpholino-phenyl)-3-nitro-benzamide CAS Name: 4-bromo-N-[2,5-diethoxy-4-(4-morpholinyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-bromo-N-(2,5-diethoxy-4-morpholin-4-ylphenyl)-3-nitrobenzamide Traditional Name: 4-bromo-N-(2,5-diethoxy-4-morpholino-phenyl)-3-nitro-benzamide Formula: C21H24BrN3O6 MolecularWeight: 494.33576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24BrN3O6/c1-3-30-19-13-18(24-7-9-29-10-8-24)20(31-4-2)12-16(19)23-21(26)14-5-6-15(22)17(11-14)25(27)28/h5-6,11-13H,3-4,7-10H2,1-2H3,(H,23,26)