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

Systemtic Name: (3-methyl-6-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methyl-phenethyl-azanium Openeye Name: (3-methyl-6-oxo-1-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methyl-phenethyl-ammonium CAS Name: (3-methyl-6-oxo-1-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methyl-phenethylammonium IUPAC Name: (3-methyl-6-oxo-1-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methyl-phenethylazanium Traditional Name: (6-keto-3-methyl-1-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methyl-phenethyl-ammonium Formula: C22H23N4O+ MolecularWeight: 359.44422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)N=C2N(N1)C3=CC=CC=C3)C[NH2+]CCC4=CC=CC=C4

Isomeric SMILES

CC1=C2C=C(C(=O)N=C2N(N1)C3=CC=CC=C3)C[NH2+]CCC4=CC=CC=C4

InChI

InChI=1S/C22H22N4O/c1-16-20-14-18(15-23-13-12-17-8-4-2-5-9-17)22(27)24-21(20)26(25-16)19-10-6-3-7-11-19/h2-11,14,23,25H,12-13,15H2,1H3/p+1