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

Systemtic Name: 2-bromanyl-6-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-bromo-6-[[2-morpholino-5-(trifluoromethyl)phenyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-bromo-6-[[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-bromo-6-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]iminomethyl]-4-nitrophenolate Traditional Name: 2-bromo-6-[[2-morpholino-5-(trifluoromethyl)phenyl]iminomethyl]-4-nitro-phenolate Formula: C18H14BrF3N3O4- MolecularWeight: 473.22067

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)N=CC3=CC(=CC(=C3[O-])Br)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)N=CC3=CC(=CC(=C3[O-])Br)[N+](=O)[O-]

InChI

InChI=1S/C18H15BrF3N3O4/c19-14-9-13(25(27)28)7-11(17(14)26)10-23-15-8-12(18(20,21)22)1-2-16(15)24-3-5-29-6-4-24/h1-2,7-10,26H,3-6H2/p-1