1-(1-ethylpiperidin-1-ium-4-yl)-6-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: 1-(1-ethylpiperidin-1-ium-4-yl)-6-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: 1-(1-ethylpiperidin-1-ium-4-yl)-6-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 1-(1-ethyl-4-piperidin-1-iumyl)-6-methyl-4-pyrazolo[3,4-b]pyridinecarboxylate IUPAC Name: 1-(1-ethylpiperidin-1-ium-4-yl)-6-methylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-(1-ethylpiperidin-1-ium-4-yl)-6-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate Formula: C15H20N4O2 MolecularWeight: 288.3449

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)N2C3=C(C=N2)C(=CC(=N3)C)C(=O)[O-]

Isomeric SMILES

CC[NH+]1CCC(CC1)N2C3=C(C=N2)C(=CC(=N3)C)C(=O)[O-]

InChI

InChI=1S/C15H20N4O2/c1-3-18-6-4-11(5-7-18)19-14-13(9-16-19)12(15(20)21)8-10(2)17-14/h8-9,11H,3-7H2,1-2H3,(H,20,21)