[2-(diethylamino)-2-oxidanylidene-ethyl] 4-oxidanyl-1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxylate

Systemtic Name: [2-(diethylamino)-2-oxidanylidene-ethyl] 4-oxidanyl-1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxylate Openeye Name: [2-(diethylamino)-2-oxo-ethyl] 4-hydroxy-1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxylate CAS Name: 4-hydroxy-1-[2-(trifluoromethyl)phenyl]-3-pyrazolecarboxylic acid [2-(diethylamino)-2-oxoethyl] ester IUPAC Name: [2-(diethylamino)-2-oxoethyl] 4-hydroxy-1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxylate Traditional Name: 4-hydroxy-1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxylic acid [2-(diethylamino)-2-keto-ethyl] ester Formula: C17H18F3N3O4 MolecularWeight: 385.33773

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)COC(=O)C1=NN(C=C1O)C2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CCN(CC)C(=O)COC(=O)C1=NN(C=C1O)C2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C17H18F3N3O4/c1-3-22(4-2)14(25)10-27-16(26)15-13(24)9-23(21-15)12-8-6-5-7-11(12)17(18,19)20/h5-9,24H,3-4,10H2,1-2H3