N-(4-methoxy-3,5-dinitro-phenyl)-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-(4-methoxy-3,5-dinitro-phenyl)-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-(4-methoxy-3,5-dinitro-phenyl)-4-morpholino-3-nitro-benzamide CAS Name: N-(4-methoxy-3,5-dinitrophenyl)-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-(4-methoxy-3,5-dinitrophenyl)-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-(4-methoxy-3,5-dinitro-phenyl)-4-morpholino-3-nitro-benzamide Formula: C18H17N5O9 MolecularWeight: 447.35568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O9/c1-31-17-15(22(27)28)9-12(10-16(17)23(29)30)19-18(24)11-2-3-13(14(8-11)21(25)26)20-4-6-32-7-5-20/h2-3,8-10H,4-7H2,1H3,(H,19,24)