ethyl 4-(2-methoxyethylamino)-3-methyl-1-(4-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-1-ium-5-carboxylate

Systemtic Name: ethyl 4-(2-methoxyethylamino)-3-methyl-1-(4-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-1-ium-5-carboxylate Openeye Name: ethyl 4-(2-methoxyethylamino)-3-methyl-1-(p-tolyl)-2H-pyrazolo[3,4-b]pyridin-1-ium-5-carboxylate CAS Name: 4-(2-methoxyethylamino)-3-methyl-1-(4-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-1-ium-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-methoxyethylamino)-3-methyl-1-(4-methylphenyl)-2H-pyrazolo[3,4-b]pyridin-1-ium-5-carboxylate Traditional Name: 4-(2-methoxyethylamino)-3-methyl-1-(p-tolyl)-2H-pyrazolo[3,4-b]pyridin-1-ium-5-carboxylic acid ethyl ester Formula: C20H25N4O3+ MolecularWeight: 369.4375

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N[N+](=C2N=C1)C3=CC=C(C=C3)C)C)NCCOC

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N[N+](=C2N=C1)C3=CC=C(C=C3)C)C)NCCOC

InChI

InChI=1S/C20H24N4O3/c1-5-27-20(25)16-12-22-19-17(18(16)21-10-11-26-4)14(3)23-24(19)15-8-6-13(2)7-9-15/h6-9,12H,5,10-11H2,1-4H3,(H,21,22,23,25)/p+1