(3,3-dimethyl-2-oxidanylidene-butyl) 6-methyl-4-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 6-methyl-4-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 6-methyl-4-oxo-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxylate CAS Name: 6-methyl-4-oxo-1-[3-(trifluoromethyl)phenyl]-3-pyridazinecarboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 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-keto-3,3-dimethyl-butyl) ester Formula: C19H19F3N2O4 MolecularWeight: 396.36037

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)OCC(=O)C(C)(C)C

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)OCC(=O)C(C)(C)C

InChI

InChI=1S/C19H19F3N2O4/c1-11-8-14(25)16(17(27)28-10-15(26)18(2,3)4)23-24(11)13-7-5-6-12(9-13)19(20,21)22/h5-9H,10H2,1-4H3