N,4,5-trimethyl-3-[2-nitro-4-(trifluoromethyl)phenoxy]pyrazole-1-carboxamide

Systemtic Name: N,4,5-trimethyl-3-[2-nitro-4-(trifluoromethyl)phenoxy]pyrazole-1-carboxamide Openeye Name: N,4,5-trimethyl-3-[2-nitro-4-(trifluoromethyl)phenoxy]pyrazole-1-carboxamide CAS Name: N,4,5-trimethyl-3-[2-nitro-4-(trifluoromethyl)phenoxy]-1-pyrazolecarboxamide IUPAC Name: N,4,5-trimethyl-3-[2-nitro-4-(trifluoromethyl)phenoxy]pyrazole-1-carboxamide Traditional Name: N,4,5-trimethyl-3-[2-nitro-4-(trifluoromethyl)phenoxy]pyrazole-1-carboxamide Formula: C14H13F3N4O4 MolecularWeight: 358.27263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)NC)C

Isomeric SMILES

CC1=C(N(N=C1OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)NC)C

InChI

InChI=1S/C14H13F3N4O4/c1-7-8(2)20(13(22)18-3)19-12(7)25-11-5-4-9(14(15,16)17)6-10(11)21(23)24/h4-6H,1-3H3,(H,18,22)