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

Systemtic Name: ethyl 5-ethyl-2-(4-fluorophenyl)-4-nitro-pyrazole-3-carboxylate Openeye Name: ethyl 5-ethyl-2-(4-fluorophenyl)-4-nitro-pyrazole-3-carboxylate CAS Name: 5-ethyl-2-(4-fluorophenyl)-4-nitro-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-(4-fluorophenyl)-4-nitropyrazole-3-carboxylate Traditional Name: 5-ethyl-2-(4-fluorophenyl)-4-nitro-pyrazole-3-carboxylic acid ethyl ester Formula: C14H14FN3O4 MolecularWeight: 307.277063

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1[N+](=O)[O-])C(=O)OCC)C2=CC=C(C=C2)F

Isomeric SMILES

CCC1=NN(C(=C1[N+](=O)[O-])C(=O)OCC)C2=CC=C(C=C2)F

InChI

InChI=1S/C14H14FN3O4/c1-3-11-12(18(20)21)13(14(19)22-4-2)17(16-11)10-7-5-9(15)6-8-10/h5-8H,3-4H2,1-2H3