ethyl 4-[2-(4-fluorophenyl)-2-oxidanylidene-ethoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 4-[2-(4-fluorophenyl)-2-oxidanylidene-ethoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate Openeye Name: ethyl 4-[2-(4-fluorophenyl)-2-oxo-ethoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate CAS Name: 4-[2-(4-fluorophenyl)-2-oxoethoxy]-1-(4-nitrophenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-fluorophenyl)-2-oxoethoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate Traditional Name: 4-[2-(4-fluorophenyl)-2-keto-ethoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C20H16FN3O6 MolecularWeight: 413.355943

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1OCC(=O)C2=CC=C(C=C2)F)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NN(C=C1OCC(=O)C2=CC=C(C=C2)F)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H16FN3O6/c1-2-29-20(26)19-18(30-12-17(25)13-3-5-14(21)6-4-13)11-23(22-19)15-7-9-16(10-8-15)24(27)28/h3-11H,2,12H2,1H3