(E)-N-(4-methoxy-3,5-dinitro-phenyl)-3-(4-morpholin-4-yl-3-nitro-phenyl)prop-2-enamide

Systemtic Name: (E)-N-(4-methoxy-3,5-dinitro-phenyl)-3-(4-morpholin-4-yl-3-nitro-phenyl)prop-2-enamide Openeye Name: (E)-N-(4-methoxy-3,5-dinitro-phenyl)-3-(4-morpholino-3-nitro-phenyl)prop-2-enamide CAS Name: (E)-N-(4-methoxy-3,5-dinitrophenyl)-3-[4-(4-morpholinyl)-3-nitrophenyl]-2-propenamide IUPAC Name: (E)-N-(4-methoxy-3,5-dinitrophenyl)-3-(4-morpholin-4-yl-3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(4-methoxy-3,5-dinitro-phenyl)-3-(4-morpholino-3-nitro-phenyl)acrylamide Formula: C20H19N5O9 MolecularWeight: 473.39296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C=CC2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C20H19N5O9/c1-33-20-17(24(29)30)11-14(12-18(20)25(31)32)21-19(26)5-3-13-2-4-15(16(10-13)23(27)28)22-6-8-34-9-7-22/h2-5,10-12H,6-9H2,1H3,(H,21,26)/b5-3+