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

Systemtic Name: 5-methyl-3-oxidanylidene-2-phenyl-N-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Openeye Name: 5-methyl-3-oxo-2-phenyl-N-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide CAS Name: 5-methyl-3-oxo-2-phenyl-N-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide IUPAC Name: 5-methyl-3-oxo-2-phenyl-N-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Traditional Name: 3-keto-5-methyl-2-phenyl-N-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Formula: C21H16F3N4O2+ MolecularWeight: 413.37255

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15F3N4O2/c1-27-11-16(19(29)25-14-7-5-6-13(10-14)21(22,23)24)18-17(12-27)20(30)28(26-18)15-8-3-2-4-9-15/h2-12H,1H3,(H,25,29)/p+1