(2-methoxy-2-oxidanylidene-ethyl) 1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-4-carboxylate

Systemtic Name: (2-methoxy-2-oxidanylidene-ethyl) 1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-4-carboxylate Openeye Name: (2-methoxy-2-oxo-ethyl) 1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-4-carboxylate CAS Name: 1-(4-fluorophenyl)-3-(3-methoxyphenyl)-4-pyrazolecarboxylic acid (2-methoxy-2-oxoethyl) ester IUPAC Name: (2-methoxy-2-oxoethyl) 1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-4-carboxylate Traditional Name: 1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-4-carboxylic acid (2-keto-2-methoxy-ethyl) ester Formula: C20H17FN2O5 MolecularWeight: 384.357783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)OCC(=O)OC)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)OCC(=O)OC)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H17FN2O5/c1-26-16-5-3-4-13(10-16)19-17(20(25)28-12-18(24)27-2)11-23(22-19)15-8-6-14(21)7-9-15/h3-11H,12H2,1-2H3