2-ethyl-4-nitro-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]pyrazole-3-carboxamide

Systemtic Name: 2-ethyl-4-nitro-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]pyrazole-3-carboxamide Openeye Name: 2-ethyl-4-nitro-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]pyrazole-3-carboxamide CAS Name: 2-ethyl-4-nitro-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]-3-pyrazolecarboxamide IUPAC Name: 2-ethyl-4-nitro-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]pyrazole-3-carboxamide Traditional Name: 2-ethyl-4-nitro-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]pyrazole-3-carboxamide Formula: C19H14F3N5O6 MolecularWeight: 465.33957

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=CC(=CC(=C2)OC3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=CC(=CC(=C2)OC3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H14F3N5O6/c1-2-25-17(16(10-23-25)27(31)32)18(28)24-12-7-13(26(29)30)9-15(8-12)33-14-5-3-4-11(6-14)19(20,21)22/h3-10H,2H2,1H3,(H,24,28)