2-ethyl-4-nitro-N-[1-[2,2,2-tris(fluoranyl)ethoxymethyl]pyrazol-4-yl]pyrazole-3-carboxamide

Systemtic Name: 2-ethyl-4-nitro-N-[1-[2,2,2-tris(fluoranyl)ethoxymethyl]pyrazol-4-yl]pyrazole-3-carboxamide Openeye Name: 2-ethyl-4-nitro-N-[1-(2,2,2-trifluoroethoxymethyl)pyrazol-4-yl]pyrazole-3-carboxamide CAS Name: 2-ethyl-4-nitro-N-[1-(2,2,2-trifluoroethoxymethyl)-4-pyrazolyl]-3-pyrazolecarboxamide IUPAC Name: 2-ethyl-4-nitro-N-[1-(2,2,2-trifluoroethoxymethyl)pyrazol-4-yl]pyrazole-3-carboxamide Traditional Name: 2-ethyl-4-nitro-N-[1-(2,2,2-trifluoroethoxymethyl)pyrazol-4-yl]pyrazole-3-carboxamide Formula: C12H13F3N6O4 MolecularWeight: 362.26463

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=CN(N=C2)COCC(F)(F)F

Isomeric SMILES

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=CN(N=C2)COCC(F)(F)F

InChI

InChI=1S/C12H13F3N6O4/c1-2-20-10(9(4-17-20)21(23)24)11(22)18-8-3-16-19(5-8)7-25-6-12(13,14)15/h3-5H,2,6-7H2,1H3,(H,18,22)