N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-1,2,4-triazol-3-yl]-2-ethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-1,2,4-triazol-3-yl]-2-ethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[1-[(2-chloro-4-fluoro-phenyl)methyl]-1,2,4-triazol-3-yl]-2-ethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-2-ethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-2-ethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[1-(2-chloro-4-fluoro-benzyl)-1,2,4-triazol-3-yl]-2-ethyl-4-nitro-pyrazole-3-carboxamide Formula: C15H13ClFN7O3 MolecularWeight: 393.760223

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=NN(C=N2)CC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=NN(C=N2)CC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C15H13ClFN7O3/c1-2-23-13(12(6-19-23)24(26)27)14(25)20-15-18-8-22(21-15)7-9-3-4-10(17)5-11(9)16/h3-6,8H,2,7H2,1H3,(H,20,21,25)