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

Systemtic Name: 5-[(4-fluorophenyl)methyl]-N-(2-methylpropyl)-3-oxidanylidene-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Openeye Name: 5-[(4-fluorophenyl)methyl]-N-isobutyl-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide CAS Name: 5-[(4-fluorophenyl)methyl]-N-(2-methylpropyl)-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide IUPAC Name: 5-[(4-fluorophenyl)methyl]-N-(2-methylpropyl)-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Traditional Name: 5-(4-fluorobenzyl)-N-isobutyl-3-keto-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Formula: C24H24FN4O2+ MolecularWeight: 419.471363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=C2C(=C[N+](=C1)CC3=CC=C(C=C3)F)C(=O)N(N2)C4=CC=CC=C4

Isomeric SMILES

CC(C)CNC(=O)C1=C2C(=C[N+](=C1)CC3=CC=C(C=C3)F)C(=O)N(N2)C4=CC=CC=C4

InChI

InChI=1S/C24H23FN4O2/c1-16(2)12-26-23(30)20-14-28(13-17-8-10-18(25)11-9-17)15-21-22(20)27-29(24(21)31)19-6-4-3-5-7-19/h3-11,14-16H,12-13H2,1-2H3,(H,26,30)/p+1