methyl 1-(4-fluoranyl-2-nitro-phenyl)pyrazole-4-carboxylate

Systemtic Name: methyl 1-(4-fluoranyl-2-nitro-phenyl)pyrazole-4-carboxylate Openeye Name: methyl 1-(4-fluoro-2-nitro-phenyl)pyrazole-4-carboxylate CAS Name: 1-(4-fluoro-2-nitrophenyl)-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-fluoro-2-nitrophenyl)pyrazole-4-carboxylate Traditional Name: 1-(4-fluoro-2-nitro-phenyl)pyrazole-4-carboxylic acid methyl ester Formula: C11H8FN3O4 MolecularWeight: 265.197323

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(N=C1)C2=C(C=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CN(N=C1)C2=C(C=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C11H8FN3O4/c1-19-11(16)7-5-13-14(6-7)9-3-2-8(12)4-10(9)15(17)18/h2-6H,1H3