[3-(4-methylphenyl)-6-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl]methyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: [3-(4-methylphenyl)-6-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl]methyl-(pyridin-3-ylmethyl)azanium Openeye Name: [6-oxo-1-phenyl-3-(p-tolyl)-2H-pyrazolo[3,4-b]pyridin-5-yl]methyl-(3-pyridylmethyl)ammonium CAS Name: [3-(4-methylphenyl)-6-oxo-1-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl]methyl-(3-pyridinylmethyl)ammonium IUPAC Name: [3-(4-methylphenyl)-6-oxo-1-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl]methyl-(pyridin-3-ylmethyl)azanium Traditional Name: [6-keto-1-phenyl-3-(p-tolyl)-2H-pyrazolo[3,4-b]pyridin-5-yl]methyl-(3-pyridylmethyl)ammonium Formula: C26H24N5O+ MolecularWeight: 422.50166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C=C(C(=O)N=C3N(N2)C4=CC=CC=C4)C[NH2+]CC5=CN=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C=C(C(=O)N=C3N(N2)C4=CC=CC=C4)C[NH2+]CC5=CN=CC=C5

InChI

InChI=1S/C26H23N5O/c1-18-9-11-20(12-10-18)24-23-14-21(17-28-16-19-6-5-13-27-15-19)26(32)29-25(23)31(30-24)22-7-3-2-4-8-22/h2-15,28,30H,16-17H2,1H3/p+1