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

Systemtic Name: [4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 6-methyl-4-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxylate Openeye Name: [4-(2-oxopyrrolidin-1-yl)phenyl] 6-methyl-4-oxo-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxylate CAS Name: 6-methyl-4-oxo-1-[3-(trifluoromethyl)phenyl]-3-pyridazinecarboxylic acid [4-(2-oxo-1-pyrrolidinyl)phenyl] ester IUPAC Name: [4-(2-oxopyrrolidin-1-yl)phenyl] 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 [4-(2-ketopyrrolidino)phenyl] ester Formula: C23H18F3N3O4 MolecularWeight: 457.40193

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)OC3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)OC3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C23H18F3N3O4/c1-14-12-19(30)21(27-29(14)17-5-2-4-15(13-17)23(24,25)26)22(32)33-18-9-7-16(8-10-18)28-11-3-6-20(28)31/h2,4-5,7-10,12-13H,3,6,11H2,1H3