2-ethoxy-6-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-ethoxy-6-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-ethoxy-6-[[2-morpholino-5-(trifluoromethyl)phenyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-ethoxy-6-[[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-ethoxy-6-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]iminomethyl]-4-nitrophenolate Traditional Name: 2-ethoxy-6-[[2-morpholino-5-(trifluoromethyl)phenyl]iminomethyl]-4-nitro-phenolate Formula: C20H19F3N3O5- MolecularWeight: 438.37717

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20F3N3O5/c1-2-31-18-11-15(26(28)29)9-13(19(18)27)12-24-16-10-14(20(21,22)23)3-4-17(16)25-5-7-30-8-6-25/h3-4,9-12,27H,2,5-8H2,1H3/p-1