6-(4-ethylpiperazin-4-ium-1-yl)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: 6-(4-ethylpiperazin-4-ium-1-yl)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: 6-(4-ethylpiperazin-4-ium-1-yl)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 6-(4-ethyl-1-piperazin-4-iumyl)-1,3-dimethyl-5-pyrazolo[3,4-b]pyridinecarboxylate IUPAC Name: 6-(4-ethylpiperazin-4-ium-1-yl)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 6-(4-ethylpiperazin-4-ium-1-yl)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxylate Formula: C15H21N5O2 MolecularWeight: 303.35954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C3C(=NN(C3=N2)C)C)C(=O)[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C3C(=NN(C3=N2)C)C)C(=O)[O-]

InChI

InChI=1S/C15H21N5O2/c1-4-19-5-7-20(8-6-19)14-12(15(21)22)9-11-10(2)17-18(3)13(11)16-14/h9H,4-8H2,1-3H3,(H,21,22)