2-ethyl-N-[(4-fluorophenyl)methyl]-4-nitro-pyrazole-3-carboxamide

Systemtic Name: 2-ethyl-N-[(4-fluorophenyl)methyl]-4-nitro-pyrazole-3-carboxamide Openeye Name: 2-ethyl-N-[(4-fluorophenyl)methyl]-4-nitro-pyrazole-3-carboxamide CAS Name: 2-ethyl-N-[(4-fluorophenyl)methyl]-4-nitro-3-pyrazolecarboxamide IUPAC Name: 2-ethyl-N-[(4-fluorophenyl)methyl]-4-nitropyrazole-3-carboxamide Traditional Name: 2-ethyl-N-(4-fluorobenzyl)-4-nitro-pyrazole-3-carboxamide Formula: C13H13FN4O3 MolecularWeight: 292.265723

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NCC2=CC=C(C=C2)F

Isomeric SMILES

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C13H13FN4O3/c1-2-17-12(11(8-16-17)18(20)21)13(19)15-7-9-3-5-10(14)6-4-9/h3-6,8H,2,7H2,1H3,(H,15,19)