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

Systemtic Name: 2-methoxy-6-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-methoxy-6-[[2-morpholino-5-(trifluoromethyl)phenyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-methoxy-6-[[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-methoxy-6-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]iminomethyl]-4-nitrophenolate Traditional Name: 2-methoxy-6-[[2-morpholino-5-(trifluoromethyl)phenyl]iminomethyl]-4-nitro-phenolate Formula: C19H17F3N3O5- MolecularWeight: 424.35059

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)[N+](=O)[O-])C=NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3)[O-]

Isomeric SMILES

COC1=C(C(=CC(=C1)[N+](=O)[O-])C=NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3)[O-]

InChI

InChI=1S/C19H18F3N3O5/c1-29-17-10-14(25(27)28)8-12(18(17)26)11-23-15-9-13(19(20,21)22)2-3-16(15)24-4-6-30-7-5-24/h2-3,8-11,26H,4-7H2,1H3/p-1