ethyl 4-[(4Z)-4-[(4-morpholin-4-ylphenyl)methylidene]-5-oxidanylidene-3-(trifluoromethyl)pyrazol-1-yl]benzoate

Systemtic Name: ethyl 4-[(4Z)-4-[(4-morpholin-4-ylphenyl)methylidene]-5-oxidanylidene-3-(trifluoromethyl)pyrazol-1-yl]benzoate Openeye Name: ethyl 4-[(4Z)-4-[(4-morpholinophenyl)methylene]-5-oxo-3-(trifluoromethyl)pyrazol-1-yl]benzoate CAS Name: 4-[(4Z)-4-[[4-(4-morpholinyl)phenyl]methylidene]-5-oxo-3-(trifluoromethyl)-1-pyrazolyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4Z)-4-[(4-morpholin-4-ylphenyl)methylidene]-5-oxo-3-(trifluoromethyl)pyrazol-1-yl]benzoate Traditional Name: 4-[(4Z)-5-keto-4-(4-morpholinobenzylidene)-3-(trifluoromethyl)-2-pyrazolin-1-yl]benzoic acid ethyl ester Formula: C24H22F3N3O4 MolecularWeight: 473.44439

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(C=C3)N4CCOCC4)C(=N2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)/C(=C\C3=CC=C(C=C3)N4CCOCC4)/C(=N2)C(F)(F)F

InChI

InChI=1S/C24H22F3N3O4/c1-2-34-23(32)17-5-9-19(10-6-17)30-22(31)20(21(28-30)24(25,26)27)15-16-3-7-18(8-4-16)29-11-13-33-14-12-29/h3-10,15H,2,11-14H2,1H3/b20-15-