N-[3-[2,2-bis(fluoranyl)ethoxy]-5-nitro-phenyl]-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[3-[2,2-bis(fluoranyl)ethoxy]-5-nitro-phenyl]-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[3-(2,2-difluoroethoxy)-5-nitro-phenyl]-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[3-(2,2-difluoroethoxy)-5-nitrophenyl]-3,5-dimethyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[3-(2,2-difluoroethoxy)-5-nitrophenyl]-3,5-dimethyl-1-phenylpyrazole-4-carboxamide Traditional Name: N-[3-(2,2-difluoroethoxy)-5-nitro-phenyl]-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide Formula: C20H18F2N4O4 MolecularWeight: 416.378126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NC3=CC(=CC(=C3)OCC(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NC3=CC(=CC(=C3)OCC(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H18F2N4O4/c1-12-19(13(2)25(24-12)15-6-4-3-5-7-15)20(27)23-14-8-16(26(28)29)10-17(9-14)30-11-18(21)22/h3-10,18H,11H2,1-2H3,(H,23,27)