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

Systemtic Name: N-butyl-5-[(4-fluorophenyl)methyl]-3-oxidanylidene-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Openeye Name: N-butyl-5-[(4-fluorophenyl)methyl]-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide CAS Name: N-butyl-5-[(4-fluorophenyl)methyl]-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide IUPAC Name: N-butyl-5-[(4-fluorophenyl)methyl]-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Traditional Name: N-butyl-5-(4-fluorobenzyl)-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:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23FN4O2/c1-2-3-13-26-23(30)20-15-28(14-17-9-11-18(25)12-10-17)16-21-22(20)27-29(24(21)31)19-7-5-4-6-8-19/h4-12,15-16H,2-3,13-14H2,1H3,(H,26,30)/p+1