3-(4-fluoranylphenoxy)propyl 6-methyl-4-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxylate

Systemtic Name: 3-(4-fluoranylphenoxy)propyl 6-methyl-4-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxylate Openeye Name: 3-(4-fluorophenoxy)propyl 6-methyl-4-oxo-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxylate CAS Name: 6-methyl-4-oxo-1-[3-(trifluoromethyl)phenyl]-3-pyridazinecarboxylic acid 3-(4-fluorophenoxy)propyl ester IUPAC Name: 3-(4-fluorophenoxy)propyl 6-methyl-4-oxo-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxylate Traditional Name: 4-keto-6-methyl-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxylic acid 3-(4-fluorophenoxy)propyl ester Formula: C22H18F4N2O4 MolecularWeight: 450.382933

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)OCCCOC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)OCCCOC3=CC=C(C=C3)F

InChI

InChI=1S/C22H18F4N2O4/c1-14-12-19(29)20(27-28(14)17-5-2-4-15(13-17)22(24,25)26)21(30)32-11-3-10-31-18-8-6-16(23)7-9-18/h2,4-9,12-13H,3,10-11H2,1H3