2-[1-(2-butyl-3,4-dimethyl-pyrazolo[3,4-b]pyridin-6-yl)piperidin-4-yl]ethanoate

Systemtic Name: 2-[1-(2-butyl-3,4-dimethyl-pyrazolo[3,4-b]pyridin-6-yl)piperidin-4-yl]ethanoate Openeye Name: 2-[1-(2-butyl-3,4-dimethyl-pyrazolo[3,4-b]pyridin-6-yl)-4-piperidyl]acetate CAS Name: 2-[1-(2-butyl-3,4-dimethyl-6-pyrazolo[3,4-b]pyridinyl)-4-piperidinyl]acetate IUPAC Name: 2-[1-(2-butyl-3,4-dimethylpyrazolo[3,4-b]pyridin-6-yl)piperidin-4-yl]acetate Traditional Name: 2-[1-(2-butyl-3,4-dimethyl-pyrazolo[3,4-b]pyridin-6-yl)-4-piperidyl]acetate Formula: C19H27N4O2- MolecularWeight: 343.44328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C2C(=CC(=NC2=N1)N3CCC(CC3)CC(=O)[O-])C)C

Isomeric SMILES

CCCCN1C(=C2C(=CC(=NC2=N1)N3CCC(CC3)CC(=O)[O-])C)C

InChI

InChI=1S/C19H28N4O2/c1-4-5-8-23-14(3)18-13(2)11-16(20-19(18)21-23)22-9-6-15(7-10-22)12-17(24)25/h11,15H,4-10,12H2,1-3H3,(H,24,25)/p-1