[(5R)-5-(3-nitrophenyl)-5-oxidanyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-pyridin-4-yl-methanone

Systemtic Name: [(5R)-5-(3-nitrophenyl)-5-oxidanyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-pyridin-4-yl-methanone Openeye Name: [(5R)-5-hydroxy-5-(3-nitrophenyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyridyl)methanone CAS Name: [(5R)-5-hydroxy-5-(3-nitrophenyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]-pyridin-4-ylmethanone IUPAC Name: [(5R)-5-hydroxy-5-(3-nitrophenyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]-pyridin-4-ylmethanone Traditional Name: [(5R)-5-hydroxy-5-(3-nitrophenyl)-3-(trifluoromethyl)-2-pyrazolin-1-yl]-(4-pyridyl)methanone Formula: C16H11F3N4O4 MolecularWeight: 380.27815

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1(C2=CC(=CC=C2)[N+](=O)[O-])O)C(=O)C3=CC=NC=C3)C(F)(F)F

Isomeric SMILES

C1C(=NN([C@@]1(C2=CC(=CC=C2)[N+](=O)[O-])O)C(=O)C3=CC=NC=C3)C(F)(F)F

InChI

InChI=1S/C16H11F3N4O4/c17-16(18,19)13-9-15(25,11-2-1-3-12(8-11)23(26)27)22(21-13)14(24)10-4-6-20-7-5-10/h1-8,25H,9H2/t15-/m1/s1