5-methyl-3-oxidanylidene-2-phenyl-N-[4-(trifluoromethyloxy)phenyl]-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide

Systemtic Name: 5-methyl-3-oxidanylidene-2-phenyl-N-[4-(trifluoromethyloxy)phenyl]-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Openeye Name: 5-methyl-3-oxo-2-phenyl-N-[4-(trifluoromethoxy)phenyl]-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide CAS Name: 5-methyl-3-oxo-2-phenyl-N-[4-(trifluoromethoxy)phenyl]-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide IUPAC Name: 5-methyl-3-oxo-2-phenyl-N-[4-(trifluoromethoxy)phenyl]-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Traditional Name: 3-keto-5-methyl-2-phenyl-N-[4-(trifluoromethoxy)phenyl]-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Formula: C21H16F3N4O3+ MolecularWeight: 429.37195

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC(=C2C(=C1)C(=O)N(N2)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)OC(F)(F)F

Isomeric SMILES

C[N+]1=CC(=C2C(=C1)C(=O)N(N2)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C21H15F3N4O3/c1-27-11-16(19(29)25-13-7-9-15(10-8-13)31-21(22,23)24)18-17(12-27)20(30)28(26-18)14-5-3-2-4-6-14/h2-12H,1H3,(H,25,29)/p+1