ethyl 2-(4-fluorophenyl)-5-methyl-4-nitro-pyrazole-3-carboxylate

Systemtic Name: ethyl 2-(4-fluorophenyl)-5-methyl-4-nitro-pyrazole-3-carboxylate Openeye Name: ethyl 2-(4-fluorophenyl)-5-methyl-4-nitro-pyrazole-3-carboxylate CAS Name: 2-(4-fluorophenyl)-5-methyl-4-nitro-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-fluorophenyl)-5-methyl-4-nitropyrazole-3-carboxylate Traditional Name: 2-(4-fluorophenyl)-5-methyl-4-nitro-pyrazole-3-carboxylic acid ethyl ester Formula: C13H12FN3O4 MolecularWeight: 293.250483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=NN1C2=CC=C(C=C2)F)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C(=NN1C2=CC=C(C=C2)F)C)[N+](=O)[O-]

InChI

InChI=1S/C13H12FN3O4/c1-3-21-13(18)12-11(17(19)20)8(2)15-16(12)10-6-4-9(14)5-7-10/h4-7H,3H2,1-2H3