N-[4-(5-methoxy-1,3-benzoxazol-2-yl)phenyl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-[4-(5-methoxy-1,3-benzoxazol-2-yl)phenyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[4-(5-methoxy-1,3-benzoxazol-2-yl)phenyl]-4-morpholino-3-nitro-benzamide CAS Name: N-[4-(5-methoxy-1,3-benzoxazol-2-yl)phenyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-[4-(5-methoxy-1,3-benzoxazol-2-yl)phenyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-[4-(5-methoxy-1,3-benzoxazol-2-yl)phenyl]-4-morpholino-3-nitro-benzamide Formula: C25H22N4O6 MolecularWeight: 474.46538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)N5CCOCC5)[N+](=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)N5CCOCC5)[N+](=O)[O-]

InChI

InChI=1S/C25H22N4O6/c1-33-19-7-9-23-20(15-19)27-25(35-23)16-2-5-18(6-3-16)26-24(30)17-4-8-21(22(14-17)29(31)32)28-10-12-34-13-11-28/h2-9,14-15H,10-13H2,1H3,(H,26,30)