4-fluoranyl-N-[[2-oxidanylidene-6-pyrazol-1-yl-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]methyl]benzamide

Systemtic Name: 4-fluoranyl-N-[[2-oxidanylidene-6-pyrazol-1-yl-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]methyl]benzamide Openeye Name: 4-fluoro-N-[[2-oxo-6-pyrazol-1-yl-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]methyl]benzamide CAS Name: 4-fluoro-N-[[2-oxo-6-(1-pyrazolyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]methyl]benzamide IUPAC Name: 4-fluoro-N-[[2-oxo-6-pyrazol-1-yl-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]methyl]benzamide Traditional Name: 4-fluoro-N-[[2-keto-6-pyrazol-1-yl-4-(trifluoromethyl)-1H-3,1-benzoxazin-4-yl]methyl]benzamide Formula: C20H14F4N4O3 MolecularWeight: 434.343773

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC3=C(C=C2)NC(=O)OC3(CNC(=O)C4=CC=C(C=C4)F)C(F)(F)F

Isomeric SMILES

C1=CN(N=C1)C2=CC3=C(C=C2)NC(=O)OC3(CNC(=O)C4=CC=C(C=C4)F)C(F)(F)F

InChI

InChI=1S/C20H14F4N4O3/c21-13-4-2-12(3-5-13)17(29)25-11-19(20(22,23)24)15-10-14(28-9-1-8-26-28)6-7-16(15)27-18(30)31-19/h1-10H,11H2,(H,25,29)(H,27,30)