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

Systemtic Name: N-(4-butylphenyl)-5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Openeye Name: N-(4-butylphenyl)-5-methyl-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide CAS Name: N-(4-butylphenyl)-5-methyl-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide IUPAC Name: N-(4-butylphenyl)-5-methyl-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Traditional Name: N-(4-butylphenyl)-3-keto-5-methyl-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Formula: C24H25N4O2+ MolecularWeight: 401.4809

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=C3C(=C[N+](=C2)C)C(=O)N(N3)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=C3C(=C[N+](=C2)C)C(=O)N(N3)C4=CC=CC=C4

InChI

InChI=1S/C24H24N4O2/c1-3-4-8-17-11-13-18(14-12-17)25-23(29)20-15-27(2)16-21-22(20)26-28(24(21)30)19-9-6-5-7-10-19/h5-7,9-16H,3-4,8H2,1-2H3,(H,25,29)/p+1