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

Systemtic Name: [2-oxidanylidene-2-(propylamino)ethyl] 6-methyl-4-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxylate Openeye Name: [2-oxo-2-(propylamino)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-oxo-2-(propylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propylamino)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-keto-2-(propylamino)ethyl] ester Formula: C18H18F3N3O4 MolecularWeight: 397.34843

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)COC(=O)C1=NN(C(=CC1=O)C)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCCNC(=O)COC(=O)C1=NN(C(=CC1=O)C)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C18H18F3N3O4/c1-3-7-22-15(26)10-28-17(27)16-14(25)8-11(2)24(23-16)13-6-4-5-12(9-13)18(19,20)21/h4-6,8-9H,3,7,10H2,1-2H3,(H,22,26)