N-(5-bromanyl-2-morpholin-4-yl-phenyl)-4-ethoxy-5-methoxy-2-nitro-benzamide

Systemtic Name: N-(5-bromanyl-2-morpholin-4-yl-phenyl)-4-ethoxy-5-methoxy-2-nitro-benzamide Openeye Name: N-(5-bromo-2-morpholino-phenyl)-4-ethoxy-5-methoxy-2-nitro-benzamide CAS Name: N-[5-bromo-2-(4-morpholinyl)phenyl]-4-ethoxy-5-methoxy-2-nitrobenzamide IUPAC Name: N-(5-bromo-2-morpholin-4-ylphenyl)-4-ethoxy-5-methoxy-2-nitrobenzamide Traditional Name: N-(5-bromo-2-morpholino-phenyl)-4-ethoxy-5-methoxy-2-nitro-benzamide Formula: C20H22BrN3O6 MolecularWeight: 480.30918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NC2=C(C=CC(=C2)Br)N3CCOCC3)OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NC2=C(C=CC(=C2)Br)N3CCOCC3)OC

InChI

InChI=1S/C20H22BrN3O6/c1-3-30-19-12-17(24(26)27)14(11-18(19)28-2)20(25)22-15-10-13(21)4-5-16(15)23-6-8-29-9-7-23/h4-5,10-12H,3,6-9H2,1-2H3,(H,22,25)