N-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-1-methyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-1-methyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-1-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-1-methyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-1-methyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[1-(2-fluorobenzyl)-1,2,4-triazol-3-yl]-1-methyl-4-nitro-pyrazole-3-carboxamide Formula: C14H12FN7O3 MolecularWeight: 345.288583

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NC2=NN(C=N2)CC3=CC=CC=C3F)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NC2=NN(C=N2)CC3=CC=CC=C3F)[N+](=O)[O-]

InChI

InChI=1S/C14H12FN7O3/c1-20-7-11(22(24)25)12(18-20)13(23)17-14-16-8-21(19-14)6-9-4-2-3-5-10(9)15/h2-5,7-8H,6H2,1H3,(H,17,19,23)