N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide

Systemtic Name: N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide Openeye Name: N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide CAS Name: N-[3-(4-chlorophenoxy)-5-nitrophenyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide IUPAC Name: N-[3-(4-chlorophenoxy)-5-nitrophenyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide Traditional Name: N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide Formula: C17H10ClF3N4O4 MolecularWeight: 426.73391

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NNC(=C3)C(F)(F)F)Cl

Isomeric SMILES

C1=CC(=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NNC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C17H10ClF3N4O4/c18-9-1-3-12(4-2-9)29-13-6-10(5-11(7-13)25(27)28)22-16(26)14-8-15(24-23-14)17(19,20)21/h1-8H,(H,22,26)(H,23,24)