2-(4-cyanophenoxy)ethyl 6-methyl-4-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxylate

Systemtic Name: 2-(4-cyanophenoxy)ethyl 6-methyl-4-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxylate Openeye Name: 2-(4-cyanophenoxy)ethyl 6-methyl-4-oxo-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxylate CAS Name: 6-methyl-4-oxo-1-[3-(trifluoromethyl)phenyl]-3-pyridazinecarboxylic acid 2-(4-cyanophenoxy)ethyl ester IUPAC Name: 2-(4-cyanophenoxy)ethyl 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 2-(4-cyanophenoxy)ethyl ester Formula: C22H16F3N3O4 MolecularWeight: 443.37535

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)OCCOC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)OCCOC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H16F3N3O4/c1-14-11-19(29)20(27-28(14)17-4-2-3-16(12-17)22(23,24)25)21(30)32-10-9-31-18-7-5-15(13-26)6-8-18/h2-8,11-12H,9-10H2,1H3